Receptor
PDB id Resolution Class Description Source Keywords
4JI9 2.4 Å EC: 2.7.10.2 JAK2 KINASE (JH1 DOMAIN) IN COMPLEX WITH TG101209 HOMO SAPIENS PROTEIN KINASE PHOSPHO-TRANSFER CATALYST TRANSFERASE-TRANSINHIBITOR COMPLEX
Ref.: 2-AMINO-[1,2,4]TRIAZOLO[1,5-A]PYRIDINES AS JAK2 INH BIOORG.MED.CHEM.LETT. V. 23 5014 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
1M3 A:1201;
B:1201;
Valid;
Valid;
none;
none;
submit data
509.667 C26 H35 N7 O2 S Cc1cn...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3KRR 1.8 Å EC: 2.7.10.2 CRYSTAL STRUCTURE OF JAK2 COMPLEXED WITH A POTENT QUINOXALIN INHIBITOR HOMO SAPIENS SMALL MOLECULE INHIBITOR ATP SITE KINASE INHIBITOR ATP-BINDISEASE MUTATION KINASE MEMBRANE NUCLEOTIDE-BINDING PHOSPHOPROTEIN PROTO-ONCOGENE SH2 DOMAIN TRANSFERASE TYPROTEIN KINASE
Ref.: POTENT AND SELECTIVE INHIBITION OF POLYCYTHEMIA BY QUINOXALINE JAK2 INHIBITOR NVP-BSK805 MOL.CANCER THER. V. 9 1945 2010
Members (49)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 35 families.
1 3LPB ic50 = 42 nM NVB C24 H23 N3 O5 S CNS(=O)(=O....
2 4E4M Ki = 11 nM 0NH C15 H19 N5 O2 S CC1(CCN(CC....
3 4HGE Ki = 11.9 nM 15V C17 H13 Cl N6 O Cc1cc(n(n1....
4 5CF6 ic50 = 8.2 nM 50O C20 H26 N6 O3 CNc1c2c(c3....
5 2XA4 ic50 < 0.003 uM AZ5 C14 H14 Cl F N8 Cc1cc([nH]....
6 5TQ4 ic50 = 4.2 nM 7GY C16 H15 N3 O2 CCc1cc(ccc....
7 5USY - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
8 3FUP ic50 = 21.7 nM MI1 C16 H20 N6 O C[C@@H]1CC....
9 3JY9 Ki = 0.001 uM JZH C21 H15 N3 O2 c1ccc2c(c1....
10 5CF5 ic50 = 2.5 nM 50W C23 H27 N7 O S CCn1c(cc2c....
11 3E62 ic50 = 40.9 uM 5B1 C7 H6 Br N3 c1cc2c(cc1....
12 4YTC - 4HW C18 H16 N8 c1ccc(cc1)....
13 4E6D Ki = 0.88 nM 0NU C16 H16 N6 O c1c[nH]c2c....
14 3TJC ic50 = 0.031 uM 0TP C19 H20 N4 O2 S CNC(=O)c1c....
15 4D0X ic50 = 0.008 uM 953 C16 H11 Cl F3 N5 O c1cc(c(cc1....
16 4GMY Ki = 0.028 uM 0X5 C16 H13 Cl2 N3 O2 c1cc(c(c(c....
17 4D0W ic50 = 0.02 uM VVQ C16 H14 Cl N5 O Cc1ccc(cc1....
18 4C61 ic50 = 0.004 uM LMM C17 H17 F N8 S Cc1csc2c1n....
19 3KRR ic50 = 0.48 nM DQX C27 H28 F2 N6 O c1cc(c2c(c....
20 5CF8 ic50 = 1.1 nM 50V C23 H28 N8 O CCn1c(cc2c....
21 4JIA Ki = 0.0006 uM 1K3 C24 H26 N6 O CN1CCN(CC1....
22 4D1S ic50 = 0.022 uM BJG C28 H30 Cl N7 O Cc1ccc(cc1....
23 4BBF ic50 = 2.2 nM O19 C25 H28 N6 O2 c1cc(ccc1c....
24 3E64 ic50 = 0.078 uM 5B3 C17 H20 N4 O2 S CC(C)(C)NS....
25 5WEV Ki = 0.15 uM 9ZS C16 H12 Cl2 N4 O c1cc(c(c(c....
26 4E6Q Ki = 4.56 nM 0NV C20 H21 N5 c1ccc(cc1)....
27 5TQ5 ic50 = 58.8 nM 7GX C22 H20 N4 O2 CCc1cc(ccc....
28 2B7A ic50 = 1 nM IZA C18 H16 F N3 O CC(C)(C)c1....
29 3E63 ic50 = 1.6 uM 5B2 C13 H11 N3 c1ccc(cc1)....
30 5TQ6 ic50 = 123.6 nM 7GV C18 H26 N6 O C[C@@H]1CC....
31 4YTF Ki = 0.007 uM 4HZ C16 H13 Cl F4 N6 O C[C@@H](C(....
32 5AEP ic50 = 0.068 uM QUP C18 H14 Cl N5 O Cc1ccc(cc1....
33 4GFM Ki = 0.06 uM 0X2 C12 H8 Cl2 N2 O2 c1cc(c(c(c....
34 3Q32 ic50 = 0.0018 uM J2I C23 H24 F2 N8 O2 Cc1cc([nH]....
35 4JI9 - 1M3 C26 H35 N7 O2 S Cc1cnc(nc1....
36 3RVG ic50 = 5 nM 17P C22 H24 N6 O Cn1cc(cn1)....
37 5TQ8 ic50 = 23.1 nM 7GS C31 H31 F N8 O2 CCc1cc(c(c....
38 3UGC - 046 C28 H30 F3 N7 O3 CC(=O)Nc1c....
39 4YTH Ki = 0.002 uM 467 C17 H15 Cl F4 N6 O CC(C)(C(=O....
40 4IVA - 1J5 C17 H19 N5 O C[C@H](c1n....
41 4BBE ic50 = 3.6 nM 3O4 C22 H23 N5 O2 CC(=O)Nc1c....
42 3IOK Ki = 0.0002 uM 1P6 C18 H16 F N7 C[C@@H](c1....
43 5CF4 ic50 = 40 nM 50Y C22 H30 N6 O2 CCn1c(cc2c....
44 5L3A Kd = 13 uM 6DP C8 H9 N3 O2 S CS(=O)(=O)....
45 4P7E - 2HB C21 H23 N5 O3 S c1cc(n2c(c....
46 4F09 Ki = 10 nM JAK C14 H17 N5 Cc1nc2cnc3....
47 4AQC ic50 = 0.9 nM 88A C23 H23 N5 O3 S CS(=O)(=O)....
48 5TQ7 - 7GT C24 H30 N6 O3 S C[C@@H]1CC....
49 3KCK Ki = 0.0008 uM 3KC C20 H12 Cl N3 O c1ccc2c(c1....
70% Homology Family (83)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 20 families.
1 5CF6 ic50 = 8.2 nM 50O C20 H26 N6 O3 CNc1c2c(c3....
2 2XA4 ic50 < 0.003 uM AZ5 C14 H14 Cl F N8 Cc1cc([nH]....
3 5TQ4 ic50 = 4.2 nM 7GY C16 H15 N3 O2 CCc1cc(ccc....
4 5USY - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
5 3FUP ic50 = 21.7 nM MI1 C16 H20 N6 O C[C@@H]1CC....
6 3JY9 Ki = 0.001 uM JZH C21 H15 N3 O2 c1ccc2c(c1....
7 5CF5 ic50 = 2.5 nM 50W C23 H27 N7 O S CCn1c(cc2c....
8 3E62 ic50 = 40.9 uM 5B1 C7 H6 Br N3 c1cc2c(cc1....
9 4YTC - 4HW C18 H16 N8 c1ccc(cc1)....
10 4E6D Ki = 0.88 nM 0NU C16 H16 N6 O c1c[nH]c2c....
11 3TJC ic50 = 0.031 uM 0TP C19 H20 N4 O2 S CNC(=O)c1c....
12 4D0X ic50 = 0.008 uM 953 C16 H11 Cl F3 N5 O c1cc(c(cc1....
13 4GMY Ki = 0.028 uM 0X5 C16 H13 Cl2 N3 O2 c1cc(c(c(c....
14 4D0W ic50 = 0.02 uM VVQ C16 H14 Cl N5 O Cc1ccc(cc1....
15 4C61 ic50 = 0.004 uM LMM C17 H17 F N8 S Cc1csc2c1n....
16 3KRR ic50 = 0.48 nM DQX C27 H28 F2 N6 O c1cc(c2c(c....
17 5CF8 ic50 = 1.1 nM 50V C23 H28 N8 O CCn1c(cc2c....
18 4JIA Ki = 0.0006 uM 1K3 C24 H26 N6 O CN1CCN(CC1....
19 4D1S ic50 = 0.022 uM BJG C28 H30 Cl N7 O Cc1ccc(cc1....
20 4BBF ic50 = 2.2 nM O19 C25 H28 N6 O2 c1cc(ccc1c....
21 3E64 ic50 = 0.078 uM 5B3 C17 H20 N4 O2 S CC(C)(C)NS....
22 2B7A ic50 = 1 nM IZA C18 H16 F N3 O CC(C)(C)c1....
23 3E63 ic50 = 1.6 uM 5B2 C13 H11 N3 c1ccc(cc1)....
24 5TQ6 ic50 = 123.6 nM 7GV C18 H26 N6 O C[C@@H]1CC....
25 4YTF Ki = 0.007 uM 4HZ C16 H13 Cl F4 N6 O C[C@@H](C(....
26 5AEP ic50 = 0.068 uM QUP C18 H14 Cl N5 O Cc1ccc(cc1....
27 4GFM Ki = 0.06 uM 0X2 C12 H8 Cl2 N2 O2 c1cc(c(c(c....
28 3Q32 ic50 = 0.0018 uM J2I C23 H24 F2 N8 O2 Cc1cc([nH]....
29 4JI9 - 1M3 C26 H35 N7 O2 S Cc1cnc(nc1....
30 3RVG ic50 = 5 nM 17P C22 H24 N6 O Cn1cc(cn1)....
31 5TQ8 ic50 = 23.1 nM 7GS C31 H31 F N8 O2 CCc1cc(c(c....
32 3UGC - 046 C28 H30 F3 N7 O3 CC(=O)Nc1c....
33 4YTH Ki = 0.002 uM 467 C17 H15 Cl F4 N6 O CC(C)(C(=O....
34 4IVA - 1J5 C17 H19 N5 O C[C@H](c1n....
35 4BBE ic50 = 3.6 nM 3O4 C22 H23 N5 O2 CC(=O)Nc1c....
36 3IOK Ki = 0.0002 uM 1P6 C18 H16 F N7 C[C@@H](c1....
37 5CF4 ic50 = 40 nM 50Y C22 H30 N6 O2 CCn1c(cc2c....
38 5L3A Kd = 13 uM 6DP C8 H9 N3 O2 S CS(=O)(=O)....
39 4P7E - 2HB C21 H23 N5 O3 S c1cc(n2c(c....
40 4F09 Ki = 10 nM JAK C14 H17 N5 Cc1nc2cnc3....
41 4AQC ic50 = 0.9 nM 88A C23 H23 N5 O3 S CS(=O)(=O)....
42 5TQ7 - 7GT C24 H30 N6 O3 S C[C@@H]1CC....
43 3KCK Ki = 0.0008 uM 3KC C20 H12 Cl N3 O c1ccc2c(c1....
44 4IVB Ki = 1.9 nM 1J5 C17 H19 N5 O C[C@H](c1n....
45 4EI4 Ki = 1.8 nM 0Q2 C15 H18 N4 O Cc1nc2cnc3....
46 4IVC Ki = 0.1 nM 1J6 C18 H21 N5 O C[C@H](c1n....
47 3EYG ic50 = 1.6 nM MI1 C16 H20 N6 O C[C@@H]1CC....
48 4K77 Ki = 235 nM 1Q4 C13 H16 N4 O c1nc2c(c(n....
49 4EHZ Ki = 10 nM JAK C14 H17 N5 Cc1nc2cnc3....
50 4I5C Ki = 1.5 nM C5I C15 H15 N7 O c1c[nH]c2c....
51 4IVD Ki = 0.3 nM 15T C19 H23 N5 O C[C@H](c1n....
52 5E1E ic50 = 0.022 uM 5JG C20 H23 Cl F N5 O2 COc1cc(c(c....
53 4E5W Ki = 22 nM 0NT C21 H28 N6 O CC(C)N1CCC....
54 5HX8 ic50 = 0.1 nM 66P C18 H21 N5 O c1ccc2c(c1....
55 3EYH ic50 = 20 nM IZA C18 H16 F N3 O CC(C)(C)c1....
56 4E4N Ki = 0.9 nM 0NL C18 H23 N5 O2 CC(C)(C)OC....
57 4E4L Ki = 1.7 nM 0NH C15 H19 N5 O2 S CC1(CCN(CC....
58 4FK6 Ki = 0.2 nM 0UJ C17 H21 N5 O2 S CS(=O)(=O)....
59 4E1Z - 0MX C24 H17 Cl N4 O4 S c1cc(cc(c1....
60 4GFO Ki = 0.24 uM 0X2 C12 H8 Cl2 N2 O2 c1cc(c(c(c....
61 4GJ3 Ki = 1.4 nM 0XP C17 H11 Cl2 F N4 O2 c1cnc(cc1N....
62 4GII Ki = 1.8 nM 0X6 C17 H12 Cl2 N4 O2 c1cnc(cc1N....
63 3NYX Ki = 32 nM TZ1 C16 H9 Cl N4 O S3 c1cc(sc1)C....
64 4GVJ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
65 3NZ0 - IZA C18 H16 F N3 O CC(C)(C)c1....
66 4GJ2 Ki = 2.5 nM 0XH C16 H12 Cl2 F N3 O2 c1cc(c(c(c....
67 3LXP - IZA C18 H16 F N3 O CC(C)(C)c1....
68 5WAL Ki = 0.0017 uM 9ZS C16 H12 Cl2 N4 O c1cc(c(c(c....
69 4GIH Ki = 0.0048 uM 0X5 C16 H13 Cl2 N3 O2 c1cc(c(c(c....
70 3LXN Ki = 4.4 nM MI1 C16 H20 N6 O C[C@@H]1CC....
71 4PY1 - 2YK C17 H16 N6 O2 S Cn1cc(cn1)....
72 3PJC ic50 = 27 nM PJC C22 H16 F3 N5 O3 c1ccc2c(c1....
73 4HVH ic50 = 19 nM 19R C15 H20 N4 O2 C[C@H](C(C....
74 5LWM ic50 = 9 nM 79T C24 H24 N6 O2 CN(C)C(=O)....
75 4I6Q ic50 = 0.03 uM 1DT C18 H18 N4 O2 C[C@@H](C1....
76 3LXK Ki = 0.2 nM MI1 C16 H20 N6 O C[C@@H]1CC....
77 3ZC6 ic50 = 0.6 nM VFC C22 H19 F N8 O2 C[C@H](C(=....
78 4HVD ic50 = 1.4 nM 933 C16 H22 N4 O C[C@@H](C(....
79 4HVI ic50 = 68.9 nM 19S C18 H23 N5 O2 C[C@H](C(=....
80 3ZEP ic50 = 0.022 uM 1NX C23 H25 N5 O3 C[C@@H](C1....
81 4QT1 ic50 = 7 nM 3C9 C16 H24 N6 O3 S CC(C)CS(=O....
82 5LWN ic50 = 17 nM 79R C25 H26 N6 O2 C[C@@H]1CC....
83 3LXL - IZA C18 H16 F N3 O CC(C)(C)c1....
50% Homology Family (728)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 5UGX - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
2 3B2T - M33 C11 H17 N5 O9 P2 C[P@](=O)(....
3 1OEC - AA2 C25 H30 Cl N5 O CC(C)(c1cc....
4 4J96 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
5 2PZP - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
6 4J98 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
7 2PVY - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
8 2PY3 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
9 2PZ5 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
10 2PWL - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
11 5UGL - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
12 5UI0 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
13 3CLY - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
14 3RI1 ic50 = 1.23 uM 3RH C18 H15 N3 c1ccc(cc1)....
15 1Y6B ic50 = 38 nM AAX C25 H24 N4 O4 S COc1ccc(cc....
16 3VHE ic50 = 6.2 nM 42Q C21 H15 F4 N5 O2 Cn1ccc2c1c....
17 1Y6A ic50 = 0.022 uM AAZ C23 H21 N3 O4 S CCS(=O)(=O....
18 2E9N ic50 = 6.2 nM 76A C29 H27 N3 O3 c1cc(ccc1c....
19 2YM3 ic50 = 1.2 uM YM3 C14 H19 N5 O3 CCOC(=O)c1....
20 2YDI - YDI C16 H20 N4 O3 S CN(C)CCOc1....
21 4RVK ic50 = 13.5 nM 3XK C19 H13 N5 O CC(=O)Nc1c....
22 2HOG ic50 = 0.3 nM 710 C24 H25 N7 O c1cc2c(cc1....
23 3IK3 ic50 = 2 nM 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
24 3QRJ ic50 = 4 nM 919 C30 H28 F N7 O3 CC(C)(C)c1....
25 3OY3 ic50 = 35.8 nM XY3 C29 H31 F3 N6 O3 Cc1ccc(cc1....
26 5HU9 ic50 = 25 nM 66K C32 H36 F3 N5 O3 Cc1ccc(cc1....
27 2G2H Ki ~ 1 uM P16 C21 H16 Cl2 N4 O2 CN1c2c(cnc....
28 3PYY - 3YY C18 H13 F N4 O2 c1ccc(cc1)....
29 1OPJ - MYR C14 H28 O2 CCCCCCCCCC....
30 3CS9 ic50 < 33 uM NIL C28 H22 F3 N7 O Cc1ccc(cc1....
31 3MSS - STI C29 H31 N7 O Cc1ccc(cc1....
32 3KFA ic50 = 25 nM B91 C29 H25 F3 N8 O Cc1ccc(cc1....
33 3MS9 - MS9 C8 H8 Cl N O2 COC(=O)c1c....
34 2GQG - 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
35 4WA9 Ki = 3800 pM AXI C22 H18 N4 O S CNC(=O)c1c....
36 2HYY ic50 = 170 nM STI C29 H31 N7 O Cc1ccc(cc1....
37 2HZI ic50 = 70 nM JIN C21 H15 Cl2 F N4 O Cc1cc(ccc1....
38 3KF4 ic50 < 0.5 nM B90 C23 H22 N7 O P Cc1ccc2c(c....
39 3K5V - STI C29 H31 N7 O Cc1ccc(cc1....
40 2HZ0 ic50 = 330 nM GIN C23 H22 F3 N3 O2 CCCc1ccc(c....
41 3UE4 - DB8 C26 H29 Cl2 N5 O3 CN1CCN(CC1....
42 2E2B ic50 = 11 nM 406 C30 H31 F3 N8 O Cc1ccc(cc1....
43 4TWP Ki = 100 pM AXI C22 H18 N4 O S CNC(=O)c1c....
44 2V7A Kd = 0.005 uM 627 C26 H30 N6 O3 CN1CCN(CC1....
45 3QRI ic50 = 0.8 nM 919 C30 H28 F N7 O3 CC(C)(C)c1....
46 1FPU Ki = 37 nM PRC C22 H18 N6 O Cc1ccc(cc1....
47 3OXZ ic50 = 8.6 nM 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
48 2QOH - P3Y C22 H20 N4 O2 CN(C)C(=O)....
49 1IEP ic50 = 100 nM STI C29 H31 N7 O Cc1ccc(cc1....
50 2F4J - VX6 C23 H28 N8 O S Cc1cc([nH]....
51 3QRK ic50 = 57 nM 9DP C24 H25 Cl2 N5 O3 CC(C)(C)c1....
52 2HIW ic50 = 8 nM 7MP C22 H18 F3 N6 O2 Cc1ccc(cc1....
53 2Z60 - P3Y C22 H20 N4 O2 CN(C)C(=O)....
54 1PXO Ki = 2 nM CK7 C14 H12 N6 O2 S Cc1c(sc(n1....
55 1H00 ic50 = 38 uM FAP C21 H23 F2 N5 O2 CN(C)C[C@@....
56 2R3R - 6SC C18 H14 Br N5 c1ccc(cc1)....
57 1B39 Kd = 0.12 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
58 2C5Y ic50 = 0.25 uM MTW C19 H15 N7 O2 c1cc(cc(c1....
59 2R3K ic50 = 100 nM SCQ C18 H14 Br N5 c1ccc(cc1)....
60 2V0D - C53 C9 H7 N3 O S [H]/N=C1/N....
61 2W1H ic50 = 0.052 uM L0F C17 H13 N5 O c1ccc(cc1)....
62 1Y91 ic50 = 0.059 uM CT9 C23 H33 N7 O2 S CC(C)c1cnn....
63 5NK3 Kd = 38.02 nM 92Q C22 H22 Cl N5 O2 S Cc1cccc(c1....
64 5NKB Kd = 0.759 nM 8ZT C25 H28 Cl N5 O3 S Cc1cccc(c1....
65 5IA3 Kd = 46 nM P17 C21 H16 Cl2 N4 O S CN1c2c(cnc....
66 5I9V - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
67 5NK8 Kd = 0.229 uM 90Z C27 H32 Cl N5 O3 S Cc1cccc(c1....
68 5I9Z Kd = 9 nM 627 C26 H30 N6 O3 CN1CCN(CC1....
69 5IA5 Kd = 25 nM GV0 C33 H37 F2 N7 O4 CN1CCN(CC1....
70 5I9W - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
71 5NK4 Kd = 1.995 nM 90E C23 H22 Cl F2 N5 O2 S Cc1cccc(c1....
72 5IA2 Kd = 19 nM L66 C22 H19 N5 O4 Cc1ccc(cc1....
73 5NKA Kd = 3.47 uM 91H C25 H25 Cl N4 O4 S Cc1cccc(c1....
74 5NKI Kd = 18.62 nM 8ZW C22 H23 Cl N4 O4 S2 Cc1cccc(c1....
75 5NK6 Kd = 0.158 uM 90W C24 H25 Cl N4 O3 S Cc1cccc(c1....
76 5I9X Kd = 30 nM DB8 C26 H29 Cl2 N5 O3 CN1CCN(CC1....
77 5NKH Kd = 25.7 nM 8ZQ C29 H29 Cl N6 O2 S Cc1cccc(c1....
78 5IA1 Kd = 530 nM ZZL C25 H15 Cl F2 N4 O2 c1cc(c(c(c....
79 5NK2 Kd = 0.182 uM 8ZZ C23 H23 Cl F N5 O2 S Cc1cccc(c1....
80 5IA0 Kd = 187 nM A5B C27 H20 Cl F N4 O4 COc1cccc(c....
81 5I9Y Kd = 2.8 nM 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
82 5NK9 Kd = 0.724 uM 912 C25 H29 Cl N4 O3 S Cc1cccc(c1....
83 1MQB - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
84 5NK5 - 90K C24 H20 Cl N5 O2 S Cc1cccc(c1....
85 5NKG Kd = 20.89 nM 8ZK C25 H28 Cl N5 O2 S CCc1cc(cc(....
86 5NJZ Kd = 16.6 nM 8ZH C23 H24 Cl N5 O2 S Cc1cccc(c1....
87 5NKF - 8ZN C24 H23 Cl F3 N5 O2 S Cc1cccc(c1....
88 5NK0 - 91E C23 H26 Cl N5 O2 S Cc1cccc(c1....
89 5NKE - 90B C23 H23 Br Cl N5 O2 S Cc1cccc(c1....
90 5NK7 Kd = 0.467 uM 8ZZ C23 H23 Cl F N5 O2 S Cc1cccc(c1....
91 5NK1 - 90N C22 H19 Cl N8 O2 S Cc1cccc(c1....
92 5NKD Kd = 26.3 nM 91K C24 H23 Cl N4 O4 S Cc1cccc(c1....
93 5NKC Kd = 18.62 nM 90T C23 H21 Cl N4 O4 S Cc1cccc(c1....
94 5IA4 Kd = 52 nM 88Z C34 H34 F2 N4 O6 COc1cc2c(c....
95 5BMM Ki = 0.01 uM FUM ALC PFF PPN ORN n/a n/a
96 3G6H ic50 = 4.6 nM G6H C32 H28 F3 N7 O4 Cc1ccc(cc1....
97 4FIC ic50 = 20 uM 0UL C11 H9 N5 c1ccc(cc1)....
98 3DQX - AMP C10 H14 N5 O7 P c1nc(c2c(n....
99 4MXO Kd = 0.73 nM DB8 C26 H29 Cl2 N5 O3 CN1CCN(CC1....
100 3F6X - IHH C22 H19 N7 c1ccc2c(c1....
101 3G6G ic50 = 18 nM G6G C35 H37 N9 O2 Cc1ccc(cc1....
102 3U51 ic50 = 25 uM 08X C38 H49 N9 O7 c1ccc(cc1)....
103 3F3T ic50 = 64.1 uM 1AU C24 H25 N5 O CC(C)(C)c1....
104 3EL8 ic50 = 25 nM PD5 C22 H20 F3 N7 O CC(C)n1c2c....
105 4LGG ic50 = 4 nM VGG C17 H21 N5 Cc1cccc(c1....
106 2OIQ Kd = 42 uM STI C29 H31 N7 O Cc1ccc(cc1....
107 4YBK Kd = 15 nM 4B7 C27 H29 N7 O3 S Cc1nc(cc(n....
108 1YOL - S03 C25 H27 N5 O2 COc1cccc(c....
109 3F3U ic50 < 1 uM 1AW C20 H23 N5 O CC(C)(C)c1....
110 3U4W ic50 = 0.13 uM 08L C36 H46 N8 O8 c1ccc(cc1)....
111 4O2P Ki = 0.2 uM 11V C25 H27 Cl N6 O S c1ccc(cc1)....
112 2BDJ ic50 = 0.00045 uM HET C26 H30 N5 O2 P CP(=O)(C)c....
113 2BDF ic50 = 0.067 uM 24A C20 H28 N6 O5 P2 CCn1cnc2c1....
114 3GEQ - PP2 C15 H17 Cl N5 CC(C)(C)n1....
115 3EN6 ic50 = 0.235 uM KS5 C17 H16 N6 CC(C)n1c2c....
116 3UQG - B5A C11 H16 N6 c1c2c(ncnc....
117 3UQF Ki = 0.2 uM BK5 C20 H21 N5 O CCOc1ccc2c....
118 4U5J ic50 = 2.92 uM RXT C17 H18 N6 c1c[nH]c2c....
119 3G5D ic50 = 0.0004 uM 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
120 3DQW - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
121 4ZSA ic50 = 15 nM 4UT C27 H29 N5 O2 CCN1CCN(CC....
122 5B7V ic50 = 9.3 nM LWJ C20 H16 N6 O Cc1[nH]c2c....
123 3JS2 - VM1 C10 H7 N O2 S c1cc(sc1)c....
124 5A4C Kd = 5.7 nM XOJ C27 H39 N7 O3 CCN(CC)CCC....
125 5AM7 Kd = 64.5 nM 38O C21 H21 F N6 O CN1CCN(CC1....
126 1FGI - SU1 C17 H16 N2 O3 Cc1c[nH]c(....
127 4V04 Kd = 7.7 nM 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
128 4RWL Kd = 8 nM 3ZC C26 H25 N3 O4 CNC(=O)c1c....
129 4NKS Kd = 69.1 nM 2M2 C20 H21 N7 O Cc1cc(on1)....
130 4F64 ic50 = 63 nM 0S8 C16 H20 Br N7 O2 Cc1cc(on1)....
131 5EW8 - 5SF C25 H30 N6 O2 CC(C)NCCN(....
132 4RWJ Kd = 2 nM 66T C26 H33 N5 O3 C[C@@H]1CN....
133 3RHX ic50 = 0.84 uM 3RH C18 H15 N3 c1ccc(cc1)....
134 4NKA Kd = 447 nM 2K7 C22 H25 N7 O3 Cc1cc(on1)....
135 2FGI Ki = 36.4 nM PD1 C28 H41 N7 O3 CCN(CC)CCC....
136 3C4F ic50 = 1.9 uM C4F C15 H14 N2 O COc1cccc(c....
137 1AGW - SU2 C20 H21 N3 O2 c1ccc2c(c1....
138 5UR1 ic50 = 1.06 nM YY9 C31 H35 Cl2 N7 O4 CN(C)C/C=C....
139 4F65 ic50 = 2.5 nM 0S9 C20 H20 Br N7 O Cc1cc(on1)....
140 5AM6 Kd = 185 nM 38O C21 H21 F N6 O CN1CCN(CC1....
141 2OH4 ic50 = 3.5 nM GIG C23 H17 F4 N5 O4 COC(=O)Nc1....
142 3CP9 - C19 C24 H23 N5 O CC1=C(C(=O....
143 3BE2 ic50 = 2 nM RAJ C29 H29 F3 N6 O Cc1ccc(cc1....
144 2P2H ic50 = 68 nM 994 C23 H22 N6 O3 COc1cc(cc(....
145 4AG8 Ki = 1.1 nM AXI C22 H18 N4 O S CNC(=O)c1c....
146 3CPC - C52 C21 H15 F3 N4 O CC1=C(C(=O....
147 3CJG - KIM C22 H24 N6 O3 Cc1c2ccc(c....
148 3VO3 ic50 = 1.4 nM 0KF C22 H21 N7 O3 Cc1cc(n(n1....
149 3VNT ic50 = 2.2 nM 0JA C27 H19 Cl F N5 O3 S c1cc(c(c(c....
150 3WZE Kd = 33 nM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
151 1YWN ic50 ~ 0.003 uM LIF C27 H19 F4 N5 O3 COc1ccc(cc....
152 3WZD Kd = 2.1 nM LEV C21 H19 Cl N4 O4 COc1cc2c(c....
153 5EW3 ic50 = 0.0012 uM 5T2 C20 H16 F3 N3 O c1ccc(c(c1....
154 3CJF ic50 = 6.3 nM SAV C21 H22 N6 O3 Cc1c2ccc(c....
155 2QU6 Ki = 3 nM 857 C26 H26 Cl N5 O4 CNC(=O)c1c....
156 3U6J - 03X C29 H25 F N4 O5 CC1=C(C(=O....
157 3EWH ic50 = 69 nM K11 C28 H20 F3 N7 O CNc1nccc(n....
158 2P2I ic50 = 38 nM 608 C24 H20 N4 O2 c1ccc(cc1)....
159 3C7Q ic50 = 21 nM XIN C31 H33 N5 O4 CN1CCN(CC1....
160 4F1T - H52 C16 H21 N3 O2 S Cc1cncc2c1....
161 4YZN ic50 = 15.4 uM 4K5 C20 H21 F4 N5 O3 COc1cc(c(c....
162 4F1O - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
163 4F0F - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
164 5DNR - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
165 3K5U ic50 = 309 nM PFQ C20 H17 N3 O2 c1ccc(cc1)....
166 4KS8 - B49 C22 H27 F N4 O2 CCN(CC)CCN....
167 2WGJ Ki = 0.002 uM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
168 4DEH ic50 = 612 nM 0JK C21 H17 N5 O c1ccc(cc1)....
169 4IWD ic50 = 1 nM 1JC C29 H28 N6 O3 S c1ccnc(c1)....
170 3F82 ic50 = 3.9 nM 353 C25 H19 Cl F2 N4 O4 CCOC1=C(C(....
171 4XYF - 44X C24 H22 F N5 O3 Cc1cc(on1)....
172 2RFS - AM8 C23 H22 Cl N3 O3 S Cc1c(c([nH....
173 4R1V ic50 = 400 nM 3E8 C29 H28 N6 O2 CN1CCC(CC1....
174 3CTH ic50 = 0.035 uM 319 C20 H16 F2 N4 O3 c1cc(ccc1C....
175 4AOI Ki = 0.004 uM 4K0 C19 H12 N8 c1cc2c(c[n....
176 3DKC - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
177 4XMO ic50 = 2 nM 46G C22 H17 F2 N5 O2 Cc1cc(on1)....
178 4R1Y ic50 < 1 nM 3EH C26 H34 N4 O5 S CCN(CC)CCC....
179 4GG5 ic50 = 0.93 nM 0J3 C22 H22 F3 N5 O2 CN1CCN(CC1....
180 4AP7 Ki = 0.011 uM F47 C17 H12 F N5 O c1cc(ccc1C....
181 3Q6W Kd = 27 nM Q6W C31 H30 N6 O2 c1ccnc(c1)....
182 3CD8 ic50 = 9 nM L5G C22 H17 N5 O2 COc1ccc2c(....
183 4EEV ic50 = 42 nM L1X C30 H22 F2 N6 O3 CC1=CC=C(C....
184 3RHK ic50 = 520 nM M97 C23 H16 N3 O2 c1ccc2c(c1....
185 4GG7 ic50 = 6.5 nM 0J8 C23 H21 F3 N8 O2 c1cc(cc(c1....
186 3ZZE Ki = 0.0013 uM 6XP C18 H18 Cl N3 O3 Cc1ccc(c2c....
187 3U6I - 044 C30 H27 F N4 O5 CC1=C(C(=O....
188 4DEI ic50 = 1 nM 0JL C23 H22 N6 O3 S Cc1cc(sn1)....
189 2WD1 ic50 = 82 nM ZZY C14 H10 N4 O5 S c1ccc(c(c1....
190 3CE3 ic50 = 1.8 nM 1FN C25 H16 F2 N4 O3 c1cc(ccc1N....
191 3LQ8 ic50 = 0.4 nM 88Z C34 H34 F2 N4 O6 COc1cc2c(c....
192 3EFK Ki = 14 nM MT4 C28 H22 F2 N4 O4 CN1C(=O)C(....
193 3ZCL Ki = 0.0101 uM 5TF C17 H19 N7 C[C@@H](c1....
194 5UAB - 84M C16 H13 N7 O S c1ccn2c(c1....
195 3ZC5 Ki = 0.0103 uM W9Z C20 H17 N7 C[C@@H](c1....
196 3U6H Ki = 1 nM 03X C29 H25 F N4 O5 CC1=C(C(=O....
197 3ZBX Ki = 0.006 uM 6XE C20 H13 F N6 c1cc2cc(cc....
198 1R0P Kd = 10 nM KSA C27 H21 N3 O5 C[C@@]12[C....
199 5HOR ic50 = 6 nM 63K C25 H23 F N8 O2 S2 c1cc(ccc1c....
200 5HO6 ic50 = 204 nM 63K C25 H23 F N8 O2 S2 c1cc(ccc1c....
201 3VW8 - DF6 C26 H23 N3 O4 S COc1cc2c(c....
202 3L8V ic50 = 0.008 uM L8V C23 H16 F3 N5 O2 c1cc(c(nc1....
203 5EYD ic50 = 1 nM 5T1 C23 H22 F N7 O3 C[C@H](c1n....
204 4DEG ic50 = 6 nM 0JJ C19 H16 N8 O S Cc1cc(sn1)....
205 5HLW ic50 = 23 nM 62E C26 H28 N8 O S3 CCN1CCC(CC....
206 5HNI ic50 = 10 nM 63B C20 H14 F N7 O2 S COC(=O)Nc1....
207 3R7O - M61 C28 H32 N6 O5 S CN(C[C@@H]....
208 3DKG - SX8 C18 H13 N7 S Cn1cc(cn1)....
209 5EOB ic50 = 0.24 nM 5QQ C20 H11 F3 N6 c1cc2cc(cc....
210 5HOA ic50 = 64 nM 63K C25 H23 F N8 O2 S2 c1cc(ccc1c....
211 5UAF - 84P C21 H19 N9 O Cn1cc(cn1)....
212 3ZXZ Ki = 0.005 uM KRW C19 H16 N8 O c1cc2cc(cc....
213 3DKF ic50 = 4 nM SX8 C18 H13 N7 S Cn1cc(cn1)....
214 5EYC ic50 = 3 nM 5SZ C20 H15 F N6 O2 Cc1cc(on1)....
215 3CTJ ic50 = 0.11 uM 320 C22 H16 F2 N4 O3 c1cc(ccc1C....
216 2RFN ic50 = 5 nM AM7 C35 H35 F N4 O5 CN1C(=NC=C....
217 3QTI ic50 = 14 nM 3QT C20 H16 N6 Cn1cc(cn1)....
218 3CCN ic50 = 120 nM LKG C18 H14 N4 O c1ccc(cc1)....
219 3F66 ic50 = 0.9 uM IHX C20 H19 F3 N4 O CN1CCN(CC1....
220 2WKM ic50 = 9 nM PFY C32 H34 Cl2 N4 O4 S Cc1c([nH]c....
221 3I5N ic50 = 17 nM B2D C21 H17 N7 O COc1cc2c(c....
222 4KNB ic50 = 0.047 uM 1RU C23 H22 Cl2 F N5 O2 C[C@H](c1c....
223 5AUU ic50 = 21 uM LU2 C15 H10 O6 c1cc(c(cc1....
224 3TUC ic50 = 100 nM FPW C29 H24 N4 O5 COc1cc2c(c....
225 4YJQ - 4DK C24 H23 N7 O2 Cc1c(ocn1)....
226 4I0R ic50 = 14 nM 1B4 C19 H22 N4 O4 CC(C)NC(=O....
227 4YJP - 4DL C20 H19 N7 O3 S c1cc2c(cn[....
228 5C27 - GLU VAL TYR GLU SER n/a n/a
229 5LMB ic50 = 16 nM 6ZF C20 H25 N7 CN(C)c1ccc....
230 5TR6 ic50 = 3.2 nM 7KG C17 H21 F N6 O Cn1cc(cn1)....
231 4XG4 ic50 = 21.5 nM X4G C24 H30 F N5 O3 Cc1cc(cc(c....
232 4WNM Ki = 18 nM 3RT C24 H29 N7 O2 c1cc(n2c(c....
233 4YJT - 4DQ C20 H18 F N7 O2 S CCN(c1cccc....
234 4PV0 Kd = 4 nM CG4 C28 H23 N5 O5 COc1ccc(cc....
235 4FYO ic50 = 47 nM 0VF C25 H24 N6 O5 S COc1ccc(cc....
236 5LMA ic50 = 0.25 uM 6ZG C18 H21 N5 Cc1ccc(cc1....
237 3FQE Ki = 0.02 uM P5C C18 H24 N6 O Cc1cccc(c1....
238 4FYN - 0VE C22 H23 N5 O2 CCN(CCO)c1....
239 4I0T ic50 = 26 nM 1B6 C18 H22 N6 O CC(C)(C)NC....
240 4YJS - 4DN C21 H21 N7 O3 S c1cc2c(cn[....
241 4FL1 Kd = 520 uM ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
242 4RX8 ic50 = 35 nM 3YX C18 H22 N8 O c1cc2cc[nH....
243 5CXZ ic50 = 552 nM 55U C19 H23 N5 CN(C)c1ccc....
244 5TT7 ic50 = 13 nM 7KF C19 H24 N6 O Cc1cccc(c1....
245 5CY3 ic50 = 16 nM 55Y C16 H16 N4 O3 S C[C@H]([C@....
246 3TUD ic50 = 2.1 nM FPX C29 H22 F3 N5 O2 Cc1ccc(cc1....
247 4FZ6 ic50 = 127 nM 0VG C22 H22 N6 C[C@H]1CCC....
248 4YJU - 4DO C19 H16 F N7 O2 S CN(c1cccc2....
249 4XG6 ic50 = 9.7 nM X6G C20 H24 N6 O Cc1cc(cc(c....
250 3VF9 ic50 = 358.2 nM 477 C19 H19 F2 N3 O S CCC(CC)(c1....
251 3FQH ic50 = 0.57 uM 057 C21 H22 N4 O2 CC(C)(CO)N....
252 3FQS ic50 = 0.041 uM 585 C22 H23 F N6 O5 CC1(C(=O)N....
253 4DFL ic50 = 2.4 uM 0K0 C18 H24 N6 O3 S CS(=O)(=O)....
254 5TIU ic50 = 5 nM 7CU C16 H18 N6 O C[C@@H](CN....
255 1XBC ic50 = 0.012 uM STU C28 H26 N4 O3 C[C@@]12[C....
256 4PUZ ic50 = 7.7 nM CG9 C23 H21 N7 O c1cc(ccc1N....
257 4XG3 ic50 = 17.5 nM X3G C23 H28 F N5 O4 S Cc1cc(cc(c....
258 4XG7 ic50 = 32.6 nM X7G C20 H22 N8 O Cc1c(cn(n1....
259 3TUB ic50 = 320 nM FPU C26 H24 N4 O4 COc1cc2c(c....
260 4XG8 ic50 = 1.9 nM X8G C20 H21 Cl N8 O Cc1c(cn(n1....
261 1XBB Ki = 5 uM STI C29 H31 N7 O Cc1ccc(cc1....
262 4F4P ic50 = 0.6 nM 0SB C21 H20 F3 N5 c1cc(cc(c1....
263 4RX7 ic50 = 5 nM 3YV C18 H22 N10 O c1cc(cc(c1....
264 4YJO - 4DF C20 H18 Cl N7 O2 S CCN(c1cccc....
265 4RSS ic50 = 1.7 nM 4MG C23 H27 N7 O Cc1c(n(c2c....
266 5CXH ic50 = 5 nM 55M C20 H21 N3 O4 S C[C@H]([C@....
267 3VF8 ic50 = 150 nM 0JE C17 H21 F N6 O2 CCN(CC)C(=....
268 5C26 ic50 = 0.17 uM 50H C21 H19 N5 O3 COc1ccc(cc....
269 4PX6 ic50 = 4 nM 2X6 C21 H23 N7 O c1cc2cc[nH....
270 4RX9 ic50 = 19 nM 3YT C19 H23 N9 O c1cc(cc(c1....
271 4DFN ic50 = 0.04 uM 0K1 C25 H28 N6 O2 Cn1cc(cn1)....
272 4YJR - 4DJ C22 H22 N8 O Cn1c2ccc(c....
273 4I0S ic50 = 36 nM 1B5 C18 H17 Cl N6 O CC(C)NC(=O....
274 4GK3 - L87 C19 H21 N5 O2 CCCCn1c(cn....
275 3FY2 - LYS GLN TRP ASP ASN TYR GLU PHE ILE TRP n/a n/a
276 4TWO ic50 = 8000 nM 37W C19 H22 N2 O4 S Cc1ccc(cc1....
277 4P4C - 25Q C18 H15 N5 O2 COc1cccc(c....
278 4GK2 - L66 C22 H19 N5 O4 Cc1ccc(cc1....
279 4TWN - B96 C31 H37 N5 O3 Cc1ccc(cc1....
280 2QOQ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
281 4GK4 - L90 C20 H21 N7 O2 CCCCn1c(cn....
282 3FXX - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
283 2QO7 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
284 4P5Q - Q0B C22 H22 Cl N5 O2 CCOCCCNC(=....
285 2QOC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
286 4P5Z Kd = 39.3 nM Q7M C25 H18 F3 N7 O2 c1ccc2c(c1....
287 2QO9 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
288 4XV2 ic50 = 0.0054 uM P06 C23 H20 F3 N5 O2 S2 CC(C)(C)c1....
289 3OG7 - 032 C23 H18 Cl F2 N3 O3 S CCCS(=O)(=....
290 4XV9 ic50 = 0.19 uM 1OO C21 H11 Cl F5 N3 O3 S c1cc(ccc1C....
291 5ITA - 6DC C19 H19 N5 O3 S CCCS(=O)(=....
292 5JRQ - 6N9 C24 H23 F2 N3 O4 S CCCS(Nc1cc....
293 4XV1 ic50 = 0.0042 uM 904 C24 H22 F2 N6 O3 S CCN(C)S(=O....
294 4EWH Ki = 0.0003 uM T77 C26 H29 N5 O S2 CN(C)CCOc1....
295 3EQP - T95 C33 H38 N6 O4 CCOc1ccccc....
296 1U4D - DBQ C11 H11 N5 O2 c1c[nH]c2c....
297 3EQR Ki = 0.002 uM T74 C29 H38 N8 O Cc1cccc(c1....
298 1U59 ic50 = 55.8 nM STU C28 H26 N4 O3 C[C@@]12[C....
299 5DA3 ic50 = 80 nM 58V C23 H22 Cl N7 O2 c1cc(c(cc1....
300 4OTF ic50 = 0.006 uM 2VL C33 H36 N6 O3 S Cc1c(cccc1....
301 5BQ0 ic50 = 15 nM 4US C25 H23 Cl N4 O2 CN1CCN(CC1....
302 3PIZ ic50 = 3.5 uM 03C C23 H26 N4 O3 S Cc1ccccc1n....
303 5JRS ic50 = 30 nM 6MV C30 H23 F N4 O3 CC(C)(c1cc....
304 5FBO ic50 = 0.31 nM 5WH C29 H27 F4 N7 O2 C[C@H]1CC[....
305 5KUP ic50 = 7.5 nM 6XL C28 H26 F N7 O3 CC(C)(C)c1....
306 3GEN - B43 C23 H22 N4 O c1ccc(cc1)....
307 4NWM ic50 = 0.038 uM 2P5 C34 H35 N7 O3 Cc1c(cccc1....
308 5P9H - 7G7 C34 H37 F N8 O3 CC(C)(C)c1....
309 4RFY ic50 = 100 nM 3OU C34 H36 N6 O5 CN1C=C(C=C....
310 4OT5 - 481 C35 H37 N7 O2 CC(C)(C)c1....
311 4ZLY ic50 = 3.5 uM 4RU C9 H8 N4 O c1ccc2c(c1....
312 5U9D ic50 = 0.00055 uM 83P C27 H24 N6 O3 CNC(=O)[C@....
313 4OTQ - 2V2 C27 H29 N5 O3 Cc1c(cccc1....
314 5VGO Ki = 1.28 nM 9B1 C29 H29 N5 O3 S CC1(Cc2c3c....
315 3PJ3 ic50 = 5.6 uM 04L C29 H23 N5 O2 Cc1ccc(cc1....
316 3PIX ic50 = 0.1 uM 027 C20 H27 N7 O Cc1cc(n[nH....
317 5P9G - 7G6 C35 H35 F N6 O3 CN1CCN(CC1....
318 3PJ2 ic50 = 7.2 uM 04K C26 H28 F N5 O3 CCN(CC)CCO....
319 5T18 ic50 = 0.5 nM 73T C32 H30 F2 N4 O4 Cc1c(cccc1....
320 5P9I - 1E8 C25 H24 N6 O2 C=CC(=O)N1....
321 4Z3V ic50 = 4 nM 4L6 C17 H14 N6 O Cc1cc2cn[n....
322 4RG0 ic50 = 50 nM 3P0 C36 H38 F N7 O3 CC(C)(C#N)....
323 5BPY - 4UQ C33 H40 N6 O4 CC(C)(C)c1....
324 5FBN ic50 = 0.17 nM 5WF C29 H28 F3 N7 O3 CC1(COC1)C....
325 3PJ1 ic50 = 0.048 uM LHL C25 H28 Cl2 N6 O2 CCN(CC)CCO....
326 4RFZ ic50 = 40 nM 3OV C34 H33 F N6 O5 CN1C=C(C=C....
327 4ZLZ ic50 = 100 nM 4RV C15 H13 N5 O Cc1ccncc1c....
328 4Y95 - 746 C34 H37 N5 O4 Cc1c(cccc1....
329 4RX5 ic50 = 3 nM 3YO C27 H24 F N7 O2 S Cc1c(ccc(c....
330 4OT6 - 2V1 C31 H28 N6 O5 S CS(=O)(=O)....
331 4OTR - 2V3 C36 H37 F N6 O3 CCN1CCN(CC....
332 5P9F - 2VL C33 H36 N6 O3 S Cc1c(cccc1....
333 3K54 - 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
334 5JFV ic50 = 6 nM 6K1 C23 H21 Cl N6 O2 CC(C)n1cc(....
335 4YNE - 4EK C21 H18 F N5 c1ccnc(c1)....
336 4PMM ic50 = 662 nM 31V C27 H26 N8 O2 Cc1cn(cn1)....
337 4PMP ic50 = 4233 nM 31W C21 H18 F3 N3 O2 S c1cc(cc(c1....
338 5H3Q ic50 = 6 nM 7HF C26 H31 F2 N5 O3 CCOc1c(c(n....
339 5KMI - 6UE C25 H20 N4 O Cc1ncc(c(n....
340 5KML - 6UH C19 H16 F3 N3 O2 Cc1c(c(no1....
341 4PMT ic50 = 997 nM 31Y C23 H23 N7 O c1cc(cnc1)....
342 5KMM - 6UJ C22 H18 N4 O Cc1ncc(c(n....
343 4YPS - 4F6 C23 H18 F N5 O c1cc(cc(c1....
344 5JFW ic50 = 62 nM 6K2 C24 H20 N6 O2 CC(C)n1cc(....
345 5JFX ic50 = 6 nM 6K4 C23 H22 Cl N7 O3 CC(C)(CO)n....
346 5KMN - 6UK C20 H17 F3 N4 O Cc1ncc(c(n....
347 5JFS ic50 = 2 nM 6K0 C22 H19 F2 N7 O2 CC(C)n1cc(....
348 5KMJ - 6UF C20 H17 N3 O S c1ccc2c(c1....
349 5KMK - 6UG C20 H13 F5 N2 O Cc1ccc(c(n....
350 4YMJ ic50 = 83 nM 4EJ C20 H15 N5 c1ccc(cc1)....
351 4QMM ic50 = 0.46 uM 35R C19 H23 N7 O2 c1cc2c(cc1....
352 4QMU ic50 = 1.3 uM SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
353 4W8E - 3JB C20 H17 N7 O2 Cc1nc(no1)....
354 4QMZ ic50 = 0.21 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
355 4QNA ic50 = 0.023 uM X11 C9 H9 N5 O c1ccc(c(c1....
356 4QMO ic50 = 0.019 uM 34L C13 H8 N4 O S c1cc2c(c3c....
357 4QMY ic50 = 0.004 uM STU C28 H26 N4 O3 C[C@@]12[C....
358 3A7J - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
359 4W8D - 3JA C14 H16 N6 O Cn1cc(cn1)....
360 4QMN ic50 = 0.003 uM DB8 C26 H29 Cl2 N5 O3 CN1CCN(CC1....
361 4QMS ic50 = 7.4 uM 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
362 4QMV ic50 = 0.023 uM 34W C23 H25 F3 N6 O2 CC(=O)NCC(....
363 3A7I - ADE C5 H5 N5 c1[nH]c2c(....
364 1OPK - MYR C14 H28 O2 CCCCCCCCCC....
365 5MO4 - NIL C28 H22 F3 N7 O Cc1ccc(cc1....
366 2FO0 - P16 C21 H16 Cl2 N4 O2 CN1c2c(cnc....
367 3D94 ic50 = 118 nM D94 C30 H31 N7 CN1CCN(CC1....
368 2OJ9 ic50 = 0.39 uM BMI C22 H19 N7 O Cc1cc(cc2c....
369 3I81 ic50 = 13 nM EBI C23 H24 F N9 O C[C@]1(CCC....
370 5HZN ic50 = 0.06 uM 66A C27 H29 N5 O c1ccc(cc1)....
371 4D2R ic50 = 3.3 uM DYK C24 H26 N6 O2 CN1CCC(CC1....
372 3O23 ic50 = 0.5 uM MQY C21 H16 F3 N3 O4 S C[C@H]1C(=....
373 3NW6 ic50 = 7 nM LGW C22 H21 F N8 O c1cc2c(nc(....
374 3NW5 ic50 = 8400 nM LGX C22 H21 F N8 O c1cc2c(nc(....
375 2ZM3 ic50 = 2.42 uM 575 C21 H20 Br N3 O2 c1cc(ccc1C....
376 1JQH - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
377 3NW7 ic50 = 5.3 nM LGV C19 H17 F N8 O c1cc2c(nc(....
378 2C0I - L1G C33 H39 N9 O2 Cn1c2ccccc....
379 3VRZ - VRZ C25 H26 N6 O c1ccc(cc1)....
380 1QCF - PP1 C16 H19 N5 Cc1ccc(cc1....
381 3VS3 - VSE C29 H34 N6 O CN1CCN(CC1....
382 2C0T - L3G C32 H36 N8 O3 Cn1c2ccccc....
383 3VS1 - VSA C24 H24 N6 O c1ccc(cc1)....
384 3VS6 - VSH C20 H26 N6 O3 CC(C)n1c2c....
385 3VRY ic50 = 7.7 nM B43 C23 H22 N4 O c1ccc(cc1)....
386 4JDI - ARG ARG ARG ARG SER TRP TYR n/a n/a
387 1U5R - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
388 2SRC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
389 1Y57 ic50 = 1633 nM MPZ C28 H29 N7 O CN1CCN(CC1....
390 3BRB - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
391 5U6C Ki < 0.05 nM 7YS C21 H22 Cl F N6 O3 Cc1c-2c(n(....
392 5TC0 ic50 = 25 nM 79Y C18 H19 N5 O4 S2 CS(=O)(=O)....
393 5K0X ic50 = 4.4 nM K0X C24 H34 F N7 O2 c1cc(ccc1C....
394 2P0C - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
395 3W32 ic50 = 75 nM W32 C25 H23 Cl F3 N5 O4 S CS(=O)(=O)....
396 5CAU Ki = 1.6 nM 4ZR C21 H25 F4 N7 O2 C[C@H](c1n....
397 5D41 ic50 = 0.024 uM 57N C19 H15 N3 O2 S c1ccc(cc1)....
398 4I22 - IRE C22 H24 Cl F N4 O3 COc1cc2c(c....
399 2ITV - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
400 3POZ ic50 = 23 nM 03P C26 H25 Cl F3 N5 O3 CC(C)(CC(=....
401 5HCY Ki = 1.2 nM 60D C26 H30 N8 O4 S CC(C)n1cc(....
402 5CAP Ki = 52 nM 4ZH C19 H26 N6 O3 S Cc1nc2cnc(....
403 3W33 ic50 = 36 nM W19 C25 H22 Cl N5 O3 S c1cc(c2ccs....
404 2ITN - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
405 4RJ8 Ki = 17 nM 3QS C22 H28 N6 O COC1CCN(CC....
406 5CAS Ki = 1.4 nM 4ZQ C21 H25 F4 N7 O2 C[C@H](c1n....
407 3VJN - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
408 3UG2 Kd = 5.6 nM IRE C22 H24 Cl F N4 O3 COc1cc2c(c....
409 5CNN - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
410 5CAQ Ki = 2.7 nM 4ZJ C20 H26 F N7 O Cc1nc2cnc(....
411 2RGP ic50 = 0.3 uM HYZ C24 H27 F N8 c1cc(cc(c1....
412 5UGA Ki = 161 nM 8BM C25 H35 N9 O CC(C)n1cnc....
413 5CNO - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
414 5C8N Ki = 492 nM 4YX C22 H32 N8 O Cc1nc2cnc(....
415 1XKK Ki = 3 nM FMM C29 H26 Cl F N4 O4 S CS(=O)(=O)....
416 3BEL ic50 = 0.014 uM POX C22 H22 F N7 O2 COCCO/N=C/....
417 3LPB ic50 = 42 nM NVB C24 H23 N3 O5 S CNS(=O)(=O....
418 4E4M Ki = 11 nM 0NH C15 H19 N5 O2 S CC1(CCN(CC....
419 4HGE Ki = 11.9 nM 15V C17 H13 Cl N6 O Cc1cc(n(n1....
420 5CF6 ic50 = 8.2 nM 50O C20 H26 N6 O3 CNc1c2c(c3....
421 2XA4 ic50 < 0.003 uM AZ5 C14 H14 Cl F N8 Cc1cc([nH]....
422 5TQ4 ic50 = 4.2 nM 7GY C16 H15 N3 O2 CCc1cc(ccc....
423 5USY - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
424 3FUP ic50 = 21.7 nM MI1 C16 H20 N6 O C[C@@H]1CC....
425 3JY9 Ki = 0.001 uM JZH C21 H15 N3 O2 c1ccc2c(c1....
426 5CF5 ic50 = 2.5 nM 50W C23 H27 N7 O S CCn1c(cc2c....
427 3E62 ic50 = 40.9 uM 5B1 C7 H6 Br N3 c1cc2c(cc1....
428 4YTC - 4HW C18 H16 N8 c1ccc(cc1)....
429 4E6D Ki = 0.88 nM 0NU C16 H16 N6 O c1c[nH]c2c....
430 3TJC ic50 = 0.031 uM 0TP C19 H20 N4 O2 S CNC(=O)c1c....
431 4D0X ic50 = 0.008 uM 953 C16 H11 Cl F3 N5 O c1cc(c(cc1....
432 4GMY Ki = 0.028 uM 0X5 C16 H13 Cl2 N3 O2 c1cc(c(c(c....
433 4D0W ic50 = 0.02 uM VVQ C16 H14 Cl N5 O Cc1ccc(cc1....
434 4C61 ic50 = 0.004 uM LMM C17 H17 F N8 S Cc1csc2c1n....
435 3KRR ic50 = 0.48 nM DQX C27 H28 F2 N6 O c1cc(c2c(c....
436 5CF8 ic50 = 1.1 nM 50V C23 H28 N8 O CCn1c(cc2c....
437 4JIA Ki = 0.0006 uM 1K3 C24 H26 N6 O CN1CCN(CC1....
438 4D1S ic50 = 0.022 uM BJG C28 H30 Cl N7 O Cc1ccc(cc1....
439 4BBF ic50 = 2.2 nM O19 C25 H28 N6 O2 c1cc(ccc1c....
440 3E64 ic50 = 0.078 uM 5B3 C17 H20 N4 O2 S CC(C)(C)NS....
441 5WEV Ki = 0.15 uM 9ZS C16 H12 Cl2 N4 O c1cc(c(c(c....
442 4E6Q Ki = 4.56 nM 0NV C20 H21 N5 c1ccc(cc1)....
443 5TQ5 ic50 = 58.8 nM 7GX C22 H20 N4 O2 CCc1cc(ccc....
444 2B7A ic50 = 1 nM IZA C18 H16 F N3 O CC(C)(C)c1....
445 3E63 ic50 = 1.6 uM 5B2 C13 H11 N3 c1ccc(cc1)....
446 5TQ6 ic50 = 123.6 nM 7GV C18 H26 N6 O C[C@@H]1CC....
447 4YTF Ki = 0.007 uM 4HZ C16 H13 Cl F4 N6 O C[C@@H](C(....
448 5AEP ic50 = 0.068 uM QUP C18 H14 Cl N5 O Cc1ccc(cc1....
449 4GFM Ki = 0.06 uM 0X2 C12 H8 Cl2 N2 O2 c1cc(c(c(c....
450 3Q32 ic50 = 0.0018 uM J2I C23 H24 F2 N8 O2 Cc1cc([nH]....
451 4JI9 - 1M3 C26 H35 N7 O2 S Cc1cnc(nc1....
452 3RVG ic50 = 5 nM 17P C22 H24 N6 O Cn1cc(cn1)....
453 5TQ8 ic50 = 23.1 nM 7GS C31 H31 F N8 O2 CCc1cc(c(c....
454 3UGC - 046 C28 H30 F3 N7 O3 CC(=O)Nc1c....
455 4YTH Ki = 0.002 uM 467 C17 H15 Cl F4 N6 O CC(C)(C(=O....
456 4IVA - 1J5 C17 H19 N5 O C[C@H](c1n....
457 4BBE ic50 = 3.6 nM 3O4 C22 H23 N5 O2 CC(=O)Nc1c....
458 3IOK Ki = 0.0002 uM 1P6 C18 H16 F N7 C[C@@H](c1....
459 5CF4 ic50 = 40 nM 50Y C22 H30 N6 O2 CCn1c(cc2c....
460 5L3A Kd = 13 uM 6DP C8 H9 N3 O2 S CS(=O)(=O)....
461 4P7E - 2HB C21 H23 N5 O3 S c1cc(n2c(c....
462 4F09 Ki = 10 nM JAK C14 H17 N5 Cc1nc2cnc3....
463 4AQC ic50 = 0.9 nM 88A C23 H23 N5 O3 S CS(=O)(=O)....
464 5TQ7 - 7GT C24 H30 N6 O3 S C[C@@H]1CC....
465 3KCK Ki = 0.0008 uM 3KC C20 H12 Cl N3 O c1ccc2c(c1....
466 5AAA Ki = 0.38 nM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
467 4CLJ Ki = 0.1 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
468 4CMO Ki = 0.85 nM YPW C20 H20 F N5 O3 C[C@H](c1c....
469 5AA8 Ki = 8.6 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
470 3LCS - STU C28 H26 N4 O3 C[C@@]12[C....
471 4CCU - AWF C22 H23 F N6 O2 S Cc1c(sc(n1....
472 5IUH ic50 = 402 nM 34Y C30 H36 N8 O3 Cc1cc(ccc1....
473 2XB7 Ki = 0.65 nM GUI C30 H40 Cl N7 O3 S CC(C)S(=O)....
474 5J7H ic50 = 0.37 nM 6GY C29 H39 Cl N7 O2 P CN1CCN(CC1....
475 4CCB - OFG C19 H18 F N7 O Cc1c(c[nH]....
476 4CTC - J99 C23 H24 F N5 O2 C[C@@H]1c2....
477 4FOD ic50 = 0.0012 uM 0UV C33 H44 F N5 O3 CC(C)NC(=O....
478 4DCE ic50 = 0.174 uM 0JF C27 H33 N5 O4 Cc1ccc(cc1....
479 5AAC Ki = 1.3 nM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
480 5IUI - 45Q C23 H28 N6 O Cc1cc(ccc1....
481 5IMX - CZ4 C27 H38 Cl N7 O3 S Cc1cc(c(cc....
482 4ANQ ic50 = 605 nM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
483 4Z55 ic50 = 13 nM 4LO C30 H39 N7 O3 S Cc1cc(c(cc....
484 5A9U Ki = 0.08 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
485 4FOB ic50 = 0.005 uM 0US C30 H39 N5 O4 S C=CCNS(=O)....
486 5FTQ ic50 = 0.01 uM U4W C32 H36 F2 N6 O2 CN1CCN(CC1....
487 3AOX Kd = 2.4 nM EMH C30 H34 N4 O2 CCc1cc2c(c....
488 5AA9 Ki = 6.4 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
489 3LCT - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
490 2XBA Ki = 23.68 nM 571 C25 H27 N6 O3 CN1CCN(CC1....
491 5IUG ic50 = 177 nM 729 C31 H38 N8 O3 Cc1cc(ccc1....
492 4MKC - 4MK C28 H36 Cl N5 O3 S Cc1cc(c(cc....
493 4CTB - KVC C23 H18 F N7 O2 C[C@@H]1c2....
494 5AAB Ki = 0.88 nM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
495 2XP2 - VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
496 4CLI Ki < 0.07 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
497 4CMT Ki < 0.2 nM GWH C22 H22 F N5 O3 S C[C@H](c1c....
498 4FOC ic50 = 0.003 uM 0UU C28 H34 N4 O3 COC(=O)C1C....
499 4CNH Ki = 4 nM 3U9 C17 H18 F N5 O2 C[C@H](c1c....
500 4FNY ic50 = 0.256 uM I3K C24 H18 Cl N3 O4 COc1cc2c(c....
501 5KZ0 Ki = 22 nM 6YL C21 H24 F N5 O2 Cc1c(cn(n1....
502 4CMU Ki < 0.2 nM IV7 C21 H22 F N5 O2 Cc1c-2c(n(....
503 5FTO ic50 = 0.012 uM YMX C31 H34 F2 N6 O2 CN1CCN(CC1....
504 1MP8 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
505 2JKK ic50 = 6.24 nM BI9 C23 H25 Cl N6 O3 CNC(=O)c1c....
506 4K9Y Kd = 0.111 uM K9Y C26 H27 N9 O Cc1ccc(cc1....
507 4Q9S ic50 = 156 uM 30G C10 H9 N3 O2 c1ccc2c(c1....
508 4D5H - 9RM C11 H9 F3 N4 O CC1=C(NC(=....
509 4D4V - KB8 C15 H16 F3 N3 Cc1ccc2c(c....
510 4GU6 Kd = 44 nM 10N C22 H20 N6 O2 S CN(c1c(ccc....
511 4KAO Kd = 0.77 uM KAO C26 H27 N5 O Cc1ccc(cc1....
512 2JKM ic50 = 17.76 nM BII C25 H32 Cl N7 O3 S CC(C)NS(=O....
513 3BZ3 ic50 = 1.5 nM YAM C21 H20 F3 N7 O3 S CN(c1c(ccc....
514 4GU9 Kd = 43 uM 4GU C11 H8 F N5 c1ccc(c(c1....
515 4EBV ic50 = 0.99 uM 0O7 C18 H17 N3 O2 S CCc1ccc(cc....
516 2JKO ic50 = 7.7 nM BIJ C25 H28 Cl N7 O2 CN1CCN(CC1....
517 4I4E ic50 = 0.5 uM 1BQ C24 H26 N4 O4 S CN1c2ccc(c....
518 2J0L - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
519 4I4F ic50 = 0.64 uM 1BR C22 H26 N4 O2 S CC(C)(C)c1....
520 4BRX ic50 = 0.32 uM KGW C22 H25 N7 O3 CNC(=O)c1c....
521 4D4S - BI9 C23 H25 Cl N6 O3 CNC(=O)c1c....
522 4D58 - BI9 C23 H25 Cl N6 O3 CNC(=O)c1c....
523 4C7T ic50 = 0.14 uM 5RI C20 H22 N6 O4 CNC(=O)c1c....
524 4IVB Ki = 1.9 nM 1J5 C17 H19 N5 O C[C@H](c1n....
525 4EI4 Ki = 1.8 nM 0Q2 C15 H18 N4 O Cc1nc2cnc3....
526 4IVC Ki = 0.1 nM 1J6 C18 H21 N5 O C[C@H](c1n....
527 3EYG ic50 = 1.6 nM MI1 C16 H20 N6 O C[C@@H]1CC....
528 4K77 Ki = 235 nM 1Q4 C13 H16 N4 O c1nc2c(c(n....
529 4EHZ Ki = 10 nM JAK C14 H17 N5 Cc1nc2cnc3....
530 4I5C Ki = 1.5 nM C5I C15 H15 N7 O c1c[nH]c2c....
531 4IVD Ki = 0.3 nM 15T C19 H23 N5 O C[C@H](c1n....
532 5E1E ic50 = 0.022 uM 5JG C20 H23 Cl F N5 O2 COc1cc(c(c....
533 4E5W Ki = 22 nM 0NT C21 H28 N6 O CC(C)N1CCC....
534 5HX8 ic50 = 0.1 nM 66P C18 H21 N5 O c1ccc2c(c1....
535 3EYH ic50 = 20 nM IZA C18 H16 F N3 O CC(C)(C)c1....
536 4E4N Ki = 0.9 nM 0NL C18 H23 N5 O2 CC(C)(C)OC....
537 4E4L Ki = 1.7 nM 0NH C15 H19 N5 O2 S CC1(CCN(CC....
538 4FK6 Ki = 0.2 nM 0UJ C17 H21 N5 O2 S CS(=O)(=O)....
539 4E1Z - 0MX C24 H17 Cl N4 O4 S c1cc(cc(c1....
540 4GFO Ki = 0.24 uM 0X2 C12 H8 Cl2 N2 O2 c1cc(c(c(c....
541 4GJ3 Ki = 1.4 nM 0XP C17 H11 Cl2 F N4 O2 c1cnc(cc1N....
542 4GII Ki = 1.8 nM 0X6 C17 H12 Cl2 N4 O2 c1cnc(cc1N....
543 3NYX Ki = 32 nM TZ1 C16 H9 Cl N4 O S3 c1cc(sc1)C....
544 4GVJ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
545 3NZ0 - IZA C18 H16 F N3 O CC(C)(C)c1....
546 4GJ2 Ki = 2.5 nM 0XH C16 H12 Cl2 F N3 O2 c1cc(c(c(c....
547 3LXP - IZA C18 H16 F N3 O CC(C)(C)c1....
548 5WAL Ki = 0.0017 uM 9ZS C16 H12 Cl2 N4 O c1cc(c(c(c....
549 4GIH Ki = 0.0048 uM 0X5 C16 H13 Cl2 N3 O2 c1cc(c(c(c....
550 3C1X ic50 = 0.045 uM CKK C27 H27 F2 N7 O3 c1cc(ccc1C....
551 3LXN Ki = 4.4 nM MI1 C16 H20 N6 O C[C@@H]1CC....
552 4PY1 - 2YK C17 H16 N6 O2 S Cn1cc(cn1)....
553 4H1J ic50 = 1200 nM 0YH C26 H30 N6 O2 Cc1ccc(cc1....
554 3FZT ic50 = 637 nM 4JZ C24 H27 N7 O2 Cc1ccc(cc1....
555 3H3C ic50 = 140 nM P1E C19 H25 F3 N6 O2 S CNS(=O)(=O....
556 4H1M ic50 = 78 nM 0YJ C27 H32 N6 O2 Cc1ccc(cc1....
557 5TO8 ic50 = 3.1 nM 7FM C25 H26 F3 N7 O3 S CS(=O)(=O)....
558 3FZP - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
559 3FZS ic50 = 1.5 uM B96 C31 H37 N5 O3 Cc1ccc(cc1....
560 5FDP ic50 = 309 nM 5WR C28 H31 F3 N6 O C[C@@H]1CN....
561 4CKR ic50 = 105 nM DI1 C30 H31 F3 N4 O3 CCN1CCN(CC....
562 4BKJ ic50 = 41 nM STI C29 H31 N7 O Cc1ccc(cc1....
563 5BVN - 4VD C23 H20 F N5 O2 Cc1ccc(cc1....
564 5BVK - 4VC C13 H12 Cl N3 O c1ccc(c(c1....
565 5BVO - 4VE C24 H20 F N5 O2 Cc1ccc(cc1....
566 5BVW - 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
567 3ZOS - 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
568 3KRL ic50 = 0.8 nM KRL C22 H27 N5 O2 CN1CCN(CC1....
569 3DPK ic50 = 4.1 nM 8C5 C27 H34 N6 O3 CONC(=O)C1....
570 2I0Y - 5CN C19 H21 N3 O3 CC1CCN(CC1....
571 3BEA ic50 = 0.003 uM IXH C29 H31 N7 O2 C[C@H]1CN(....
572 2I1M - 5CN C19 H21 N3 O3 CC1CCN(CC1....
573 3KRJ ic50 = 1 nM KRJ C22 H25 N5 O c1cc(c(cc1....
574 3LCD ic50 = 40 nM BDY C27 H30 Cl2 N6 O c1cc(c(c(c....
575 2F57 - 23D C19 H24 Cl N7 CCn1cnc2c1....
576 5VAM - 92J C28 H29 F3 N4 O4 Cc1c(cc(cn....
577 5JSM ic50 = 260 nM 6NB C52 H48 F4 N6 O10 S2 CCCS(=O)(=....
578 4CQE Kd < 3 nM CQE C30 H28 F3 N5 O3 S2 CC(=O)Nc1c....
579 5VAL - 92D C26 H30 N4 O2 Cc1ccc(cc1....
580 5HID - B1E C27 H25 N5 O2 Cc1ccc(cc1....
581 4XLI Kd = 0.17 nM 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
582 2H8H ic50 = 2.7 nM H8H C27 H32 Cl N5 O5 CN1CCN(CC1....
583 4Y93 - 746 C34 H37 N5 O4 Cc1c(cccc1....
584 5DH3 ic50 = 38.1 nM 5BS C17 H16 N6 O3 S2 CN1c2ccsc2....
585 3PJC ic50 = 27 nM PJC C22 H16 F3 N5 O3 c1ccc2c(c1....
586 4HVH ic50 = 19 nM 19R C15 H20 N4 O2 C[C@H](C(C....
587 5LWM ic50 = 9 nM 79T C24 H24 N6 O2 CN(C)C(=O)....
588 4I6Q ic50 = 0.03 uM 1DT C18 H18 N4 O2 C[C@@H](C1....
589 3LXK Ki = 0.2 nM MI1 C16 H20 N6 O C[C@@H]1CC....
590 3ZC6 ic50 = 0.6 nM VFC C22 H19 F N8 O2 C[C@H](C(=....
591 4HVD ic50 = 1.4 nM 933 C16 H22 N4 O C[C@@H](C(....
592 4HVI ic50 = 68.9 nM 19S C18 H23 N5 O2 C[C@H](C(=....
593 3ZEP ic50 = 0.022 uM 1NX C23 H25 N5 O3 C[C@@H](C1....
594 4QT1 ic50 = 7 nM 3C9 C16 H24 N6 O3 S CC(C)CS(=O....
595 5LWN ic50 = 17 nM 79R C25 H26 N6 O2 C[C@@H]1CC....
596 3LXL - IZA C18 H16 F N3 O CC(C)(C)c1....
597 4CSV Ki = 910 nM STI C29 H31 N7 O Cc1ccc(cc1....
598 4ASE Ki = 0.01 nM AV9 C22 H19 Cl N4 O5 CC1=C/C(=N....
599 4AGC Ki = 0.02 nM AXI C22 H18 N4 O S CNC(=O)c1c....
600 4ASD Ki = 0.52 nM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
601 4M14 - QWS C18 H19 N5 O3 CC(C)Oc1cc....
602 3QGW Ki = 1.3 uM L7A C17 H13 N3 O2 c1ccc(cc1)....
603 3V8W ic50 = 8.6 nM 0G2 C24 H23 N3 O S CCC(CC)(c1....
604 4M15 - QWS C18 H19 N5 O3 CC(C)Oc1cc....
605 4M13 Kd = 0.2 uM 1E0 C18 H19 N5 O3 CCCOc1ccc2....
606 3QGY Ki = 0.016 uM L7O C22 H24 N6 O2 CNc1nccc(n....
607 1SM2 Ki < 10 nM STU C28 H26 N4 O3 C[C@@]12[C....
608 3MJ1 Kd = 2.1 nM 614 C23 H31 N7 O2 Cc1cc([nH]....
609 3MIY Kd = 21 nM B49 C22 H27 F N4 O2 CCN(CC)CCN....
610 3V8T ic50 = 0.3 nM 477 C19 H19 F2 N3 O S CCC(CC)(c1....
611 3V5L ic50 = 7 nM 0G1 C25 H25 N3 O2 S CCC(CC)(c1....
612 4L7S Ki = 15.8 nM G7K C24 H23 F3 N6 O2 S COc1ccc2c(....
613 4RFM Ki = 0.09 nM 3P6 C25 H27 F2 N5 O3 S C[C@@]12Cc....
614 4M12 Kd = 0.9 uM 1YZ C17 H17 N5 O3 CCOc1ccc2c....
615 4QD6 Ki = 2.3 nM 30T C26 H27 N5 O3 S c1ccc(cc1)....
616 4PQN Ki = 0.7 nM 2W6 C24 H32 N6 O CC1(CCc2c(....
617 4M0Z Kd = 6.4 uM M0Z C16 H15 N5 O3 COc1ccc2cc....
618 4KIO ic50 = 0.5 uM G5K C22 H26 N8 O2 S C=CC(=O)N1....
619 4MF1 Ki = 1.9 nM 29Y C23 H23 N5 O S CN(C)Cc1cc....
620 1SNU - STU C28 H26 N4 O3 C[C@@]12[C....
621 3MJ2 Kd = 15 nM MJG C32 H41 N5 O4 S2 Cc1cc(c(cc....
622 4M0Y Kd = 8.2 uM M0Y C15 H13 N5 O2 c1ccc2c(c1....
623 1BYG - STU C28 H26 N4 O3 C[C@@]12[C....
624 4U0I ic50 < 11 nM 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
625 1T46 - STI C29 H31 N7 O Cc1ccc(cc1....
626 3G0E Kd = 20 nM B49 C22 H27 F N4 O2 CCN(CC)CCN....
627 4HVS ic50 = 0.016 uM 647 C21 H17 F3 N4 c1cc2c(c[n....
628 1JPA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
629 3PLS - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
630 2IVS - ACK C10 H12 N5 O6 P c1nc(c2c(n....
631 2X2L ic50 = 5.3 uM X2L C16 H14 N2 O2 COc1ccc(cc....
632 2IVU Ki = 375 nM ZD6 C22 H24 Br F N4 O2 CN1CCC(CC1....
633 4CKJ - ADN C10 H13 N5 O4 c1nc(c2c(n....
634 2X2M ic50 = 0.17 uM X2M C15 H14 N2 O Cc1cc([nH]....
635 2IVV - PP1 C16 H19 N5 Cc1ccc(cc1....
636 4CKI - ADN C10 H13 N5 O4 c1nc(c2c(n....
637 3SXR - 1N1 C22 H26 Cl N7 O2 S Cc1cccc(c1....
638 3SXS - PP2 C15 H17 Cl N5 CC(C)(C)n1....
639 4O0X Ki = 0.068 uM 2OQ C19 H20 N6 O Cc1nc2ccc(....
640 4O0Y Ki = 0.06 uM 2OO C17 H19 N7 O CCNc1nc2cc....
641 2X4Z Ki = 18.7 nM X4Z C25 H28 N8 O S Cc1nc2ccsc....
642 2CDZ - 23D C19 H24 Cl N7 CCn1cnc2c1....
643 2OFU ic50 ~ 3 uM 1N9 C37 H46 N6 O7 Cc1cccc(c1....
644 2OF2 ic50 = 0.081 uM 547 C25 H26 N4 O c1ccc(cc1)....
645 3BYS ic50 = 0.5 nM AM5 C31 H30 F3 N7 O2 Cc1ccc(cc1....
646 3B2W ic50 = 0.6 nM 9NH C31 H29 F4 N7 O3 Cc1ccc(cc1....
647 1QPJ - STU C28 H26 N4 O3 C[C@@]12[C....
648 1QPE ic50 = 20 nM PP2 C15 H17 Cl N5 CC(C)(C)n1....
649 3BYU ic50 = 0.8 nM AM6 C32 H32 F3 N7 O2 Cc1ccc(cc1....
650 1QPD - STU C28 H26 N4 O3 C[C@@]12[C....
651 3BYM ic50 = 0.006 uM AM0 C25 H23 N7 O3 COc1cc(cc(....
652 2ZM1 ic50 = 220 nM KSF C18 H13 Cl N4 c1ccc(cc1)....
653 1QPC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
654 2OFV ic50 = 0.2 nM 242 C23 H17 F3 N4 O Cc1ccc(cc1....
655 3KXZ ic50 = 0.035 uM 925 C28 H32 N6 O3 CC1(CC(CC(....
656 3MPM ic50 = 30 nM 5LK C23 H26 N6 O CN1CCN(CC1....
657 3BYO ic50 = 7 nM AM9 C31 H30 N8 O Cc1cccc(c1....
658 2OG8 ic50 = 0.5 nM 1N8 C30 H31 F3 N6 O2 CCN(CC)CC(....
659 4C3F - 7KW C19 H15 N5 c1ccc(cc1)....
660 3FY0 ic50 = 1090 nM DW1 C23 H13 N3 O4 Ru C1=CC(C=C1....
661 5DFP Ki = 22 nM 59U C28 H32 Cl N7 O CCN1c2c(cn....
662 3FXZ ic50 = 130 nM FLL C30 H18 Cl F N5 O4 Ru c1ccc(cc1)....
663 4ZJJ Kd = 9.9 nM 4OR C24 H29 Cl F N5 O CCN1c2ccc(....
664 5KBR ic50 = 260 nM IPW C22 H20 Cl N5 O c1cc(ccc1C....
665 4ZLO ic50 = 54 uM 4PV C18 H18 F2 N4 CN1CCN(CC1....
666 4ZJI Kd = 340 nM 4OQ C20 H22 Cl F N4 CCN1c2ccc(....
667 5DEY Ki = 3.7 nM 59T C25 H25 Cl N6 O3 Cc1cccc(n1....
668 3Q4Z - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
669 4ZY5 Ki = 26 nM 4T5 C17 H25 N7 c1cnc(nc1N....
670 3SLS - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
671 5CEQ Ki = 0.042 uM 50F C22 H28 N6 O c1cnc(cc1C....
672 5CEP Ki = 0.145 uM 50E C17 H22 F3 N5 CC(C)n1c(c....
673 5CEO Ki < 0.0005 uM 50D C23 H26 F2 N6 O c1cnc(cc1C....
674 2J7T - 274 C28 H30 Cl N5 O4 S Cc1c([nH]c....
675 4OBP ic50 = 0.017 uM 2QU C12 H8 F N5 c1cc(nc2c1....
676 4U44 ic50 = 0.008 uM 3D9 C17 H13 N5 c1ccc(cc1)....
677 4RVT ic50 = 1.9 uM 3XM C17 H19 N O4 CCCCCC(=O)....
678 4OBO ic50 = 0.077 uM 2QV C14 H10 Cl N3 c1cc(cc(c1....
679 2VX1 ic50 = 0.22 uM 7X8 C18 H14 Cl N5 O3 c1cc(cc(c1....
680 2YN8 - STU C28 H26 N4 O3 C[C@@]12[C....
681 2VWV ic50 = 16 uM 7X3 C19 H20 Cl N5 O4 COc1ccc(cc....
682 2VX0 ic50 = 0.58 uM 7X7 C21 H20 Cl N5 O3 c1cc(cc(c1....
683 2X9F ic50 = 0.061 uM X9F C18 H16 N6 O2 S CS(=O)(=O)....
684 2VWU ic50 = 0.35 uM 7X1 C24 H27 Cl N4 O4 COc1cc2c(c....
685 2VWX ic50 = 0.04 uM 7X4 C17 H14 Cl N5 O4 S c1cc(cc(c1....
686 4BB4 - 32W C23 H21 N5 O2 COCCNC(=O)....
687 2VWW ic50 = 0.24 uM 7X2 C20 H19 Cl N4 O5 COc1cc(cc(....
688 2XVD ic50 = 0.002 uM AS6 C26 H33 N5 O4 S Cc1ccc(cc1....
689 2VWZ ic50 = 0.794 uM 7X6 C18 H16 Cl N5 O4 S CS(=O)(=O)....
690 2VWY ic50 = 0.09 uM 7X5 C18 H15 Cl N4 O4 S CS(=O)(=O)....
691 4AW5 ic50 = 765 nM 30K C30 H31 N5 O2 CCN1CCC(CC....
692 3ZEW - STU C28 H26 N4 O3 C[C@@]12[C....
693 4QRC - 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
694 4TYJ - 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
695 4UXQ Kd = 16 nM 0LI C29 H27 F3 N6 O Cc1ccc(cc1....
696 5JKG ic50 < 6.4 nM 6LF C21 H19 Cl2 N5 O2 C[C@H](c1c....
697 4AT4 ic50 = 0.012 uM T6E C20 H13 F4 N5 O S c1cc(ccc1c....
698 4AT3 ic50 = 0.004 uM LTI C16 H18 N4 O2 S2 c1ccc2c(c1....
699 4AT5 ic50 = 0.038 uM MUJ C20 H22 N4 O3 COc1ccc(cc....
700 4UXL Ki < 0.025 nM 5P8 C21 H19 F N6 O2 C[C@@H]1c2....
701 3ZBF Ki = 2.1 nM VGH C21 H22 Cl2 F N5 O C[C@H](c1c....
702 3EQH - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
703 3EQC - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
704 3EQI - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
705 2P4I ic50 = 317 nM MR9 C29 H27 F3 N6 O3 Cc1ccc(cc1....
706 4X3J - 3WR C21 H14 F4 N6 O2 c1cc(ccc1N....
707 2OO8 ic50 = 1 nM RAJ C29 H29 F3 N6 O Cc1ccc(cc1....
708 5MJA ic50 = 220 nM 7O3 C16 H12 Cl2 N4 O2 c1cc2c(cc1....
709 3QUP ic50 = 0.476 uM LUN C25 H27 F N4 O c1ccc2c(c1....
710 4FEQ ic50 = 1.1 uM 0T8 C24 H33 N7 O2 c1cnccc1CC....
711 4FF8 ic50 = 0.4 uM 14S C25 H34 N6 O3 COc1ccccc1....
712 4IBM ic50 = 1.8 uM IR1 C18 H10 N6 O c1ccc(cc1)....
713 5HHW - 60O C26 H33 N5 O2 c1cc(cc(c1....
714 1I44 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
715 3EKK ic50 = 2 nM GS2 C27 H27 F N8 O3 CNC(=O)c1c....
716 4XLV - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
717 5E1S Kd = 12 nM 5JA C29 H37 N9 O C[C@@H]1Cc....
718 3EKN ic50 = 2 nM GS3 C27 H31 F N8 O2 CC(C)N1CCN....
719 5A6N ic50 = 2.1 uM U7E C7 H7 N5 O2 S c1cc(cc(c1....
720 4K33 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
721 2HK5 ic50 = 46 nM 1BM C24 H29 N7 O CCN(CC)CCN....
722 2J51 - DKI C15 H13 F2 N7 O2 S2 c1cc(c(c(c....
723 2UV2 - GVD C22 H19 N7 c1ccc2c(c1....
724 2JFL - DKI C15 H13 F2 N7 O2 S2 c1cc(c(c(c....
725 3AQV - TAK C24 H25 N5 O c1cc(ccc1c....
726 2XYU ic50