Receptor
PDB id Resolution Class Description Source Keywords
6NMB 2.3 Å EC: 3.4.21.73 TRANEXAMIC ACID IS AN ACTIVE SITE INHIBITOR OF UROKINASE PLA ACTIVATOR HOMO SAPIENS SERINE PROTEASE FIBRINOLYSIS INHIBITOR HYDROLASE
Ref.: TRANEXAMIC ACID IS AN ACTIVE SITE INHIBITOR OF UROK PLASMINOGEN ACTIVATOR. BLOOD ADV V. 3 729 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NO3 D:301;
C:301;
A:301;
B:301;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
62.005 N O3 [N+](...
AMH B:302;
A:302;
C:302;
D:302;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Ki = 2.01 mM
157.21 C8 H15 N O2 C1CC(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1SQA 2 Å EC: 3.4.21.73 SUBSTITUTED 2-NAPHTHAMIDINE INHIBITORS OF UROKINASE HOMO SAPIENS PLASMINOGEN ACTIVATION HYDROLASE SERINE PROTEASE GLYCOPROTEIN KRINGLE EGF-LIKE DOMAIN
Ref.: INTERACTION WITH THE S1BETA-POCKET OF UROKINASE: 8-HETEROCYCLE SUBSTITUTED AND 6,8-DISUBSTITUTED 2-NAPHTHAMIDINE UROKINASE INHIBITORS. BIOORG.MED.CHEM.LETT. V. 14 3063 2004
Members (38)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1W0Z Ki = 21 nM SI1 C18 H29 N5 O5 S [H]/N=C(c1....
2 4ZHL Kd = 0.0147 uM CYS PRO ALA TYR SER ARG TYR ILE GLY CYS n/a n/a
3 2VIV ic50 = 520 nM VG2 C22 H28 Cl N3 O2 Cc1cc(cc(c....
4 1SC8 Ki = 0.036 uM 2IN C20 H25 N5 O5 S c1ccc(cc1)....
5 1OWE Ki = 0.631 uM 675 C18 H15 N3 O [H]/N=C(/c....
6 4X1Q - CYS PRO ALA TYR SER ARG TYR LEU ASP CYS n/a n/a
7 2VIP ic50 = 5.2 uM L1R C18 H20 Cl2 N2 O3 CC(C)Oc1cc....
8 5ZAF Ki = 166 nM 28I C16 H21 N7 O2 [H]/N=C(N)....
9 1SQT Ki = 0.63 uM UI3 C16 H16 N4 O3 S [H]/N=C(/c....
10 1W13 Ki = 2 nM SM1 C21 H28 N6 O5 S [H]/N=C(/N....
11 1OWH Ki = 40 nM 239 C19 H18 N4 O [H]/N=C(/c....
12 1EJN Ki = 2.4 uM AGB C19 H27 N5 O [H]/N=C(/N....
13 4ZHM Kd = 0.00081 uM MRZ CYS PRO ALA TYR SER ALA TYR ILE GLY CYS n/a n/a
14 2VIN ic50 > 1 mM 505 C11 H17 N O Cc1cccc(c1....
15 5ZA8 Ki = 508 nM 27I C16 H23 N9 O [H]/N=C(/N....
16 5ZA7 Ki = 1356 nM HMX C12 H18 Cl N7 O C1CCCN(CC1....
17 4X0W - MRZ CYS PRO ALA TYR SER DAL TYR LEU ASP CYS n/a n/a
18 1U6Q - 745 C20 H18 N2 [H]/N=C(/c....
19 5ZA9 Ki = 183 nM 50I C20 H23 N7 O2 [H]/N=C(/N....
20 2VIQ ic50 = 1.3 uM D55 C21 H28 N2 O4 CCOc1ccc(c....
21 4X1P - CYS PRO ALA TYR SER DAL TYR LEU ASP CYS MRZ n/a n/a
22 6NMB Ki = 2.01 mM AMH C8 H15 N O2 C1CC(CCC1C....
23 5ZAG Ki = 108 nM 94I C16 H21 N9 O [H]/N=C(N)....
24 5ZC5 Ki = 88 nM 09I C20 H22 F N7 O2 [H]/N=C(/N....
25 1VJ9 Ki = 0.028 uM 5IN C28 H33 N5 O6 S c1ccc(cc1)....
26 1F5K Ki = 180 uM BAM C7 H9 N2 c1ccc(cc1)....
27 5ZAE Ki = 156 nM EAU C16 H21 N7 O2 [H]/N=C(/N....
28 1OWD Ki = 6.3 nM 497 C23 H24 N4 O CC[C@H]1CN....
29 2VNT Ki = 9.9 nM QGG C15 H16 Cl N5 O4 S c1cc2c(cc1....
30 2VIO ic50 = 40 uM L1O C9 H9 Cl2 N O3 c1c(cc(c(c....
31 1F5L Ki = 5.3 uM AMR C6 H8 Cl N7 O c1(c(nc(c(....
32 5ZAJ Ki = 42 nM 32I C18 H25 N9 O3 [H]/N=C(/N....
33 2R2W Ki = 34 uM 4PG C15 H15 N3 O [H]/N=C(/N....
34 2VIW ic50 = 72 nM D56 C24 H32 Cl N3 O3 CCOc1c(cc(....
35 1W11 Ki = 6 nM SK1 C21 H27 N5 O5 S [H]/N=C(c1....
36 1SQA Ki = 0.00062 uM UI1 C23 H21 N7 O c1cnc(nc1)....
37 1VJA Ki = 0.02 uM 7IN C21 H27 N5 O6 S c1ccc(cc1)....
38 1SQO Ki = 0.035 uM UI2 C15 H13 N5 c1cc2ccc(c....
70% Homology Family (39)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 6A8N Ki = 6.8 nM CYS PRO ALA TYR SER ARG TYR ILE GLY CYS n/a n/a
2 1W0Z Ki = 21 nM SI1 C18 H29 N5 O5 S [H]/N=C(c1....
3 4ZHL Kd = 0.0147 uM CYS PRO ALA TYR SER ARG TYR ILE GLY CYS n/a n/a
4 2VIV ic50 = 520 nM VG2 C22 H28 Cl N3 O2 Cc1cc(cc(c....
5 1SC8 Ki = 0.036 uM 2IN C20 H25 N5 O5 S c1ccc(cc1)....
6 1OWE Ki = 0.631 uM 675 C18 H15 N3 O [H]/N=C(/c....
7 4X1Q - CYS PRO ALA TYR SER ARG TYR LEU ASP CYS n/a n/a
8 2VIP ic50 = 5.2 uM L1R C18 H20 Cl2 N2 O3 CC(C)Oc1cc....
9 5ZAF Ki = 166 nM 28I C16 H21 N7 O2 [H]/N=C(N)....
10 1SQT Ki = 0.63 uM UI3 C16 H16 N4 O3 S [H]/N=C(/c....
11 1W13 Ki = 2 nM SM1 C21 H28 N6 O5 S [H]/N=C(/N....
12 1OWH Ki = 40 nM 239 C19 H18 N4 O [H]/N=C(/c....
13 1EJN Ki = 2.4 uM AGB C19 H27 N5 O [H]/N=C(/N....
14 4ZHM Kd = 0.00081 uM MRZ CYS PRO ALA TYR SER ALA TYR ILE GLY CYS n/a n/a
15 2VIN ic50 > 1 mM 505 C11 H17 N O Cc1cccc(c1....
16 5ZA8 Ki = 508 nM 27I C16 H23 N9 O [H]/N=C(/N....
17 5ZA7 Ki = 1356 nM HMX C12 H18 Cl N7 O C1CCCN(CC1....
18 4X0W - MRZ CYS PRO ALA TYR SER DAL TYR LEU ASP CYS n/a n/a
19 1U6Q - 745 C20 H18 N2 [H]/N=C(/c....
20 5ZA9 Ki = 183 nM 50I C20 H23 N7 O2 [H]/N=C(/N....
21 2VIQ ic50 = 1.3 uM D55 C21 H28 N2 O4 CCOc1ccc(c....
22 4X1P - CYS PRO ALA TYR SER DAL TYR LEU ASP CYS MRZ n/a n/a
23 6NMB Ki = 2.01 mM AMH C8 H15 N O2 C1CC(CCC1C....
24 5ZAG Ki = 108 nM 94I C16 H21 N9 O [H]/N=C(N)....
25 5ZC5 Ki = 88 nM 09I C20 H22 F N7 O2 [H]/N=C(/N....
26 1VJ9 Ki = 0.028 uM 5IN C28 H33 N5 O6 S c1ccc(cc1)....
27 1F5K Ki = 180 uM BAM C7 H9 N2 c1ccc(cc1)....
28 5ZAE Ki = 156 nM EAU C16 H21 N7 O2 [H]/N=C(/N....
29 1OWD Ki = 6.3 nM 497 C23 H24 N4 O CC[C@H]1CN....
30 2VNT Ki = 9.9 nM QGG C15 H16 Cl N5 O4 S c1cc2c(cc1....
31 2VIO ic50 = 40 uM L1O C9 H9 Cl2 N O3 c1c(cc(c(c....
32 1F5L Ki = 5.3 uM AMR C6 H8 Cl N7 O c1(c(nc(c(....
33 5ZAJ Ki = 42 nM 32I C18 H25 N9 O3 [H]/N=C(/N....
34 2R2W Ki = 34 uM 4PG C15 H15 N3 O [H]/N=C(/N....
35 2VIW ic50 = 72 nM D56 C24 H32 Cl N3 O3 CCOc1c(cc(....
36 1W11 Ki = 6 nM SK1 C21 H27 N5 O5 S [H]/N=C(c1....
37 1SQA Ki = 0.00062 uM UI1 C23 H21 N7 O c1cnc(nc1)....
38 1VJA Ki = 0.02 uM 7IN C21 H27 N5 O6 S c1ccc(cc1)....
39 1SQO Ki = 0.035 uM UI2 C15 H13 N5 c1cc2ccc(c....
50% Homology Family (468)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1V2V Ki = 427 uM BEN C7 H8 N2 [H]/N=C(c1....
2 2ZDN - 49U C21 H30 N4 O2 [H]/N=C(c1....
3 2ZQ1 - 11U C21 H31 N5 O2 [H]/N=C(/c....
4 1TNH Ki = 0.43 mM FBA C7 H9 F N c1cc(ccc1C....
5 2BYA - BAM C7 H9 N2 c1ccc(cc1)....
6 6SV0 - BEN C7 H8 N2 [H]/N=C(c1....
7 1Y5A Ki = 1.33 uM TL2 C20 H22 N4 O4 [H]/N=C(c1....
8 5MNG - BAM C7 H9 N2 c1ccc(cc1)....
9 6SW0 - BEN C7 H8 N2 [H]/N=C(c1....
10 2AYW - ONO C28 H31 N5 O6 CC(C)(C)[C....
11 6SV9 - BEN C7 H8 N2 [H]/N=C(c1....
12 6SVR - BEN C7 H8 N2 [H]/N=C(c1....
13 1Y3Y Ki = 2300 nM UIR C27 H30 N4 O3 c1cc(ccc1[....
14 3PTB - BEN C7 H8 N2 [H]/N=C(c1....
15 5FXL - BEN C7 H8 N2 [H]/N=C(c1....
16 1O2I Ki = 0.052 uM 655 C19 H20 N4 O2 c1cc(c(c(c....
17 1GI6 Ki = 1.7 uM 124 C15 H14 N3 O c1ccc(c(c1....
18 5MON Kd = 3.3 mM 2AP C5 H7 N2 c1cc[nH+]c....
19 1O3D Ki = 0.074 uM 780 C20 H16 N4 O c1ccc(cc1)....
20 5F6M - BEN C7 H8 N2 [H]/N=C(c1....
21 1Y59 Ki = 1.19 uM TL1 C20 H22 N4 O4 c1cc(cc(c1....
22 1O39 Ki = 0.074 uM 780 C20 H16 N4 O c1ccc(cc1)....
23 1QL7 Kd = 15 uM ZEN C25 H27 Cl N4 O3 S c1cc(cc2c1....
24 2ZDM - 46U C21 H30 N4 O3 [H]/N=C(/c....
25 3NK8 - JKZ C9 H8 F3 N O C1CC2=C(C1....
26 1C2I - BAK C17 H16 N8 O c1cc2c(cc1....
27 1C2E - BAK C17 H16 N8 O c1cc2c(cc1....
28 1G3C Ki = 1.6 uM 109 FE 109 n/a n/a
29 1YP9 Ki = 7700 nM UIZ C31 H32 N4 O3 [H]/N=C(/c....
30 6B6T - BEN C7 H8 N2 [H]/N=C(c1....
31 1V2L Ki = 51 uM BEN C7 H8 N2 [H]/N=C(c1....
32 1Y3X Ki = 7315 nM UIB C26 H32 N4 O3 CC[C@@H]1[....
33 1OYQ Ki = 110 nM T87 C29 H31 N7 O3 [H]/N=C(/c....
34 6SY3 Ki = 497 uM LXW C26 H28 N4 O2 c1ccc(cc1)....
35 1XUG Ki = 0.09 uM BAB C17 H19 N8 c1cc2c(cc1....
36 3AAU Ki = 9 uM GZC CU n/a n/a
37 1C5S Ki = 1 uM ESX C9 H9 N2 S c1ccc2c(c1....
38 1V2N Ki = 1.25 uM BBA C23 H28 N4 O c1cc(ccc1C....
39 1XUH - BAO C17 H14 N8 O c1cc2c(cc1....
40 2G8T - MI2 C16 H15 N3 [H]/N=C(c1....
41 2BY8 - BAM C7 H9 N2 c1ccc(cc1)....
42 5MN1 Kd = 3.3 mM 2AP C5 H7 N2 c1cc[nH+]c....
43 1XUK Ki = 19 uM BAB C17 H19 N8 c1cc2c(cc1....
44 1V2J Ki = 566 uM BEN C7 H8 N2 [H]/N=C(c1....
45 5EG4 Ki = 21 nM 5N7 C42 H56 N10 O6 S [H]/N=C(c1....
46 6SVJ - BEN C7 H8 N2 [H]/N=C(c1....
47 1K1N Kd = 153 nM CCR C29 H39 N5 O7 S Cc1cc(c(c(....
48 1V2M Ki = 51 uM BEN C7 H8 N2 [H]/N=C(c1....
49 1C1T - BAB C17 H19 N8 c1cc2c(cc1....
50 1G3E Ki = 4.2 uM 109 C11 H15 N3 O3 C[C@@H](C(....
51 2FX6 Ki = 200 uM 270 C7 H7 N3 C1=CC2=NC(....
52 2ZQ2 Kd = 276 nM 13U C23 H35 N5 O2 [H]/N=C(/c....
53 1MTW - DX9 C26 H28 N4 O3 [H]/N=C(C)....
54 1QA0 - 270 C7 H7 N3 C1=CC2=NC(....
55 1F0T Ki = 1000 nM PR1 C19 H19 N5 O4 S2 c1cc2c(cc(....
56 1O3E Ki = 0.011 uM 696 C21 H17 N3 O c1ccc(cc1)....
57 1AZ8 - IN4 C20 H24 N4 O2 [H]/N=C(c1....
58 1Y3W Ki = 1680 nM UIP C26 H30 N4 O3 CC[C@@H]1[....
59 2BY9 - BAM C7 H9 N2 c1ccc(cc1)....
60 1QB6 Ki = 870 nM 623 C20 H18 F2 N5 O2 [H]/N=C(/c....
61 1O3N - 785 C15 H11 F3 N4 O2 c1cc2c(cc1....
62 3GY3 Kd = 2.36 uM PNT C19 H24 N4 O2 c1cc(ccc1C....
63 3NKK Kd = 20 uM JLZ C8 H9 F N2 [H]/N=C(/c....
64 3GY4 Kd = 8 uM PBZ C7 H10 N3 c1cc(ccc1C....
65 1TNL Ki = 13.3 mM TPA C9 H12 N c1ccc(cc1)....
66 1C2K - ABI C8 H9 N4 c1cc2c(cc1....
67 1V2K Ki = 0.65 uM ZEN C25 H27 Cl N4 O3 S c1cc(cc2c1....
68 1O3J Ki = 0.17 uM 334 C15 H13 Br N4 O Cc1cc(c(c(....
69 2BZA Ki = 1.58 mM ABN C7 H9 N c1ccc(cc1)....
70 2ZDK - 50U C22 H32 N4 O2 [H]/N=C(/c....
71 5MNQ Kd = 3.6 uM J3I C21 H32 N6 O2 [H]/N=C(N)....
72 1C5P Ki = 21 uM BAM C7 H9 N2 c1ccc(cc1)....
73 1K1M Kd = 40 nM FD4 C26 H29 N5 O4 S CC(=O)N1CC....
74 6B6R - BEN C7 H8 N2 [H]/N=C(c1....
75 1MTS - BX3 C27 H30 N4 O3 CC(=N)N1CC....
76 1UTO Kd = 5.32 mM PEA C8 H12 N c1ccc(cc1)....
77 3AAS Ki = 31 uM GUS C11 H14 N4 O3 [H]/N=C(N)....
78 1TNK Ki = 32.5 mM PRA C9 H13 N c1ccc(cc1)....
79 3GY7 Kd = 30 uM BEN C7 H8 N2 [H]/N=C(c1....
80 1O30 Ki = 0.17 uM 693 C24 H17 F N4 O5 c1ccc(c(c1....
81 2BY6 - BAM C7 H9 N2 c1ccc(cc1)....
82 2AGG - SIN ALA ALA PRO LYS n/a n/a
83 6T5W Ki = 47 uM J5K C20 H25 N5 O2 c1ccc(cc1)....
84 3GY5 Kd = 1.8 uM BRN C14 H15 N7 c1cc(ccc1C....
85 1S0R - BEN C7 H8 N2 [H]/N=C(c1....
86 6B6N - BEN C7 H8 N2 [H]/N=C(c1....
87 1C5Q Ki = 0.44 uM ESI C9 H8 I N2 S c1cc2c(cc(....
88 3T25 - BEN C7 H8 N2 [H]/N=C(c1....
89 1GHZ Ki = 16 uM 120 C13 H12 N5 O c1cc2c(cc1....
90 1C5U - ESP C8 H8 N3 S c1cc2cc(sc....
91 1N6X - ABN C7 H9 N c1ccc(cc1)....
92 1O2V Ki = 1.4 uM 847 C18 H13 Br N4 O5 c1cc2c(cc1....
93 1V2Q Ki = 73.62 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
94 6SV8 - BEN C7 H8 N2 [H]/N=C(c1....
95 1TNG Ki = 1.17 mM AMC C7 H16 N C1CCC(CC1)....
96 3T26 - BEN C7 H8 N2 [H]/N=C(c1....
97 6FID - BEN C7 H8 N2 [H]/N=C(c1....
98 5MNO Kd = 143 uM MRZ C6 H13 N3 [H]/N=C(N)....
99 4YTA - BEN C7 H8 N2 [H]/N=C(c1....
100 1GI4 Ki = 0.065 uM 122 C14 H13 N4 O c1ccc(c(c1....
101 1BTY - BEN C7 H8 N2 [H]/N=C(c1....
102 1K1P - MEL C22 H31 N5 O4 c1cc(ccc1C....
103 1V2T Ki = 19.56 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
104 1O3G Ki = 0.011 uM 696 C21 H17 N3 O c1ccc(cc1)....
105 2TIO - BEN C7 H8 N2 [H]/N=C(c1....
106 1C2D Ki = 0.0052 uM BAK C17 H16 N8 O c1cc2c(cc1....
107 1C1R Ki = 0.0235 uM BAI C16 H14 N6 c1ccc2c(c1....
108 1C2H - BAK C17 H16 N8 O c1cc2c(cc1....
109 1O36 Ki = 1.1 uM 607 C24 H19 N5 O5 c1ccc(c(c1....
110 2BY7 - BAM C7 H9 N2 c1ccc(cc1)....
111 3GY8 Kd = 1.8 uM BRN C14 H15 N7 c1cc(ccc1C....
112 5T3H - BEN C7 H8 N2 [H]/N=C(c1....
113 3ITI ic50 = 0.27 uM BRV C8 H4 Br3 N O4 c1(c(c(c(c....
114 2ZFS - 12U C22 H33 N5 O2 [H]/N=C(/c....
115 3GY6 Kd = 1.8 uM BRN C14 H15 N7 c1cc(ccc1C....
116 1O3L - 678 C17 H13 Br N3 O3 c1cc2c(cc1....
117 1BJU Ki = 6.2 uM GP6 C14 H13 Cl N4 O [H]/N=C(c1....
118 1XUJ Ki < 1 nM BOZ C17 H18 N8 O Zn c1cc2c(cc1....
119 1TX7 Ki = 25 uM 4CM C8 H11 N2 O2 P C[P@](=O)(....
120 6B6O - BEN C7 H8 N2 [H]/N=C(c1....
121 3M35 - M35 C25 H20 F4 N4 O3 S CS(=O)(=O)....
122 1MTU - BX3 C27 H30 N4 O3 CC(=N)N1CC....
123 1O32 Ki = 1.8 uM 801 C13 H11 N5 O c1cc(c(nc1....
124 3T27 - BEN C7 H8 N2 [H]/N=C(c1....
125 5LH4 - 6W4 C32 H34 N6 O2 c1ccc(cc1)....
126 1O2Q Ki = 0.021 uM 991 C20 H20 Cl N3 O2 c1cc(c(c(c....
127 1K1J Kd = 28 nM FD2 C27 H30 N4 O5 S [H]/N=C(/c....
128 5MNN - MRZ C6 H13 N3 [H]/N=C(N)....
129 1C1S - BAB C17 H19 N8 c1cc2c(cc1....
130 1QBO Ki = 18 nM 711 C27 H31 N6 O Cc1[nH]c2c....
131 1V2R Ki = 278.96 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
132 1C5R - ESI C9 H8 I N2 S c1cc2c(cc(....
133 6SVV - BEN C7 H8 N2 [H]/N=C(c1....
134 1K1O - IGN C21 H38 N6 O4 C1CCC(CC1)....
135 2ZFT - 10U C20 H29 N5 O2 c1cc(ccc1C....
136 1TIO - BAM C7 H9 N2 c1ccc(cc1)....
137 1V2U Ki = 427 uM BEN C7 H8 N2 [H]/N=C(c1....
138 1MTV - BX3 C27 H30 N4 O3 CC(=N)N1CC....
139 1Y5B Kd = 1.26 uM TL3 C20 H22 N4 O4 c1cc(ccc1C....
140 1G36 Ki = 67 nM R11 C25 H25 N7 [H]/N=C(/c....
141 6SVZ - BEN C7 H8 N2 [H]/N=C(c1....
142 1O2L - 762 C20 H15 Cl N4 O c1ccc(cc1)....
143 1TX8 Ki = 1800 uM AM4 C8 H10 N2 O2 S CS(=O)(=O)....
144 1GI1 Ki = 3.6 uM BMZ C14 H13 N4 O c1ccc(c(c1....
145 1V2W Ki = 97.79 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
146 6SV6 - BEN C7 H8 N2 [H]/N=C(c1....
147 1O3H Ki = 0.05 uM 907 C16 H14 Br N3 O Cc1cc(c(c(....
148 4NCY - BEN C7 H8 N2 [H]/N=C(c1....
149 1O35 - 802 C14 H11 F N4 O c1cc2c(cc1....
150 1PPC Ki = 0.69 uM MID C27 H31 N5 O4 S [H]/N=C(/c....
151 1TNI Ki = 0.1 mM PBN C10 H15 N c1ccc(cc1)....
152 6SVU - BEN C7 H8 N2 [H]/N=C(c1....
153 1V2S Ki = 68 uM BEN C7 H8 N2 [H]/N=C(c1....
154 1LQE Ki = 1507 nM IMA C34 H36 N5 O2 C[N+](C)(C....
155 1O2S Ki = 3.4 uM CR4 C14 H12 N4 O c1ccc(c(c1....
156 1O3M - 785 C15 H11 F3 N4 O2 c1cc2c(cc1....
157 6E5M - CYS THR LYS SER ILE PRO PRO GLN CYS n/a n/a
158 1O2X Ki = 1.4 uM 847 C18 H13 Br N4 O5 c1cc2c(cc1....
159 1O38 Ki = 0.15 uM 653 C22 H22 N5 O c1ccc(cc1)....
160 1G3B Ki = 1.8 uM 108 C11 H15 N3 O3 C[C@@H](C(....
161 1BJV Ki = 13 uM GP8 C20 H18 N4 O2 c1ccc(cc1)....
162 1C1P - BAI C16 H14 N6 c1ccc2c(c1....
163 1C2J - BAK C17 H16 N8 O c1cc2c(cc1....
164 1C2F - BAH C17 H18 N8 O2 c1cc2c(cc1....
165 3LJJ Kd = 300 nM 10U C20 H29 N5 O2 c1cc(ccc1C....
166 1O3I Ki = 0.05 uM 907 C16 H14 Br N3 O Cc1cc(c(c(....
167 1Y3V Ki = 2300 nM UIR C27 H30 N4 O3 c1cc(ccc1[....
168 1UTP Kd = 36 mM PBN C10 H15 N c1ccc(cc1)....
169 2BLV - BEN C7 H8 N2 [H]/N=C(c1....
170 6SVG - BEN C7 H8 N2 [H]/N=C(c1....
171 1TNJ Ki = 11 mM PEA C8 H12 N c1ccc(cc1)....
172 3GY2 Kd = 1.8 uM BRN C14 H15 N7 c1cc(ccc1C....
173 6T0M Ki = 39 uM GOZ C20 H26 N6 O2 c1ccc(cc1)....
174 6B6S - BEN C7 H8 N2 [H]/N=C(c1....
175 1O2P - 972 C18 H19 Cl N4 O2 CC(C)COc1c....
176 1K1I Kd = 264 nM FD1 C26 H28 N4 O5 S [H]/N=C(c1....
177 1GJ6 Ki = 0.23 uM 132 C21 H17 Cl N3 O c1ccc(cc1)....
178 3LJO Kd = 239 nM 11U C21 H31 N5 O2 [H]/N=C(/c....
179 1O2Y Ki = 1.4 uM 847 C18 H13 Br N4 O5 c1cc2c(cc1....
180 6SVN - BEN C7 H8 N2 [H]/N=C(c1....
181 1O31 Ki = 1.8 uM 801 C13 H11 N5 O c1cc(c(nc1....
182 2BY5 - BAM C7 H9 N2 c1ccc(cc1)....
183 1XUI - BAO C17 H14 N8 O c1cc2c(cc1....
184 1C5T Ki = 80 uM ESP C8 H8 N3 S c1cc2cc(sc....
185 1EB2 Ki = 16 nM BPO C28 H28 N4 O3 [H]/N=C(c1....
186 6SVB - BEN C7 H8 N2 [H]/N=C(c1....
187 1O2K Ki = 0.12 uM 656 C18 H20 N4 O2 CC(C)COc1c....
188 5LGO - 6VZ C27 H36 N6 O4 CNC(=O)[C@....
189 1GI0 - BMZ C14 H13 N4 O c1ccc(c(c1....
190 1V2P Ki = 18.45 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
191 1TPS ic50 = 10 nM OSL DLE THR ARG GLU LEU YNM VAL n/a n/a
192 1N6Y - ABN C7 H9 N c1ccc(cc1)....
193 1O34 Ki = 1.8 uM 801 C13 H11 N5 O c1cc(c(nc1....
194 6SUX - BEN C7 H8 N2 [H]/N=C(c1....
195 2ZDL - 45U C20 H28 N4 O3 [H]/N=C(/c....
196 1PPH Ki = 1.2 uM 0ZG C22 H28 N4 O3 S [H]/N=C(/c....
197 2G5N - 23M C16 H15 N3 [H]/N=C(c1....
198 1G3D Ki = 2.8 uM 108 C11 H15 N3 O3 C[C@@H](C(....
199 5MOO Kd = 48.5 mM WOT C6 H8 N c1ccc(cc1)....
200 1O2U Ki = 1.4 uM 847 C18 H13 Br N4 O5 c1cc2c(cc1....
201 1O2R - CR9 C21 H23 F N4 O2 C[C@H]1CCC....
202 3QK1 - BEN C7 H8 N2 [H]/N=C(c1....
203 6SVX - BEN C7 H8 N2 [H]/N=C(c1....
204 5MNH Kd = 20.7 uM BAM C7 H9 N2 c1ccc(cc1)....
205 6B6P - BEN C7 H8 N2 [H]/N=C(c1....
206 3T29 - BEN C7 H8 N2 [H]/N=C(c1....
207 6EAT - CYS THR LYS SER ILE PRO PRO GLN CYS n/a n/a
208 1O2H Ki = 0.068 uM CR3 C20 H21 N3 O2 c1cc(c(c(c....
209 1QB9 Ki = 36 nM 806 C31 H31 N5 O [H]/N=C(/C....
210 2BLW - BEN C7 H8 N2 [H]/N=C(c1....
211 1O3B Ki = 0.074 uM 780 C20 H16 N4 O c1ccc(cc1)....
212 1O2Z Ki = 0.78 uM 312 C25 H20 N4 O6 COc1ccccc1....
213 1K1L Kd = 125 nM FD3 C24 H27 N5 O3 S [H]/N=C(/c....
214 1O2O Ki = 0.44 uM 950 C18 H19 F N4 O2 CC(C)COc1c....
215 1C1Q - BAI C16 H14 N6 c1ccc2c(c1....
216 1F0U Ki = 69 nM RPR C27 H30 N4 O3 C[C@H]([C@....
217 1C2G - BAH C17 H18 N8 O2 c1cc2c(cc1....
218 1O37 Ki = 0.15 uM 653 C22 H22 N5 O c1ccc(cc1)....
219 1O3F Ki = 0.011 uM 696 C21 H17 N3 O c1ccc(cc1)....
220 1JIR - AML C5 H13 N CCCCCN
221 1O2N Ki = 0.81 uM 762 C20 H15 Cl N4 O c1ccc(cc1)....
222 1O3O - 785 C15 H11 F3 N4 O2 c1cc2c(cc1....
223 1CE5 Ki = 18.4 uM BEN C7 H8 N2 [H]/N=C(c1....
224 5MNB Kd = 3.3 mM 2AP C5 H7 N2 c1cc[nH+]c....
225 6DZF - BEN C7 H8 N2 [H]/N=C(c1....
226 5LH8 - 6WH C31 H38 N6 O3 COc1cc(ccc....
227 2ZHD - 12U C22 H33 N5 O2 [H]/N=C(/c....
228 1O2J Ki = 0.12 uM 656 C18 H20 N4 O2 CC(C)COc1c....
229 1AQ7 ic50 = 0.9 uM 34H DIL XPR AG2 n/a n/a
230 1O3K Ki = 0.17 uM 334 C15 H13 Br N4 O Cc1cc(c(c(....
231 2G5V - 22M C16 H15 N3 [H]/N=C(c1....
232 1Y5U Kd = 0.22 uM TL4 C20 H22 N4 O4 c1cc(cc(c1....
233 6SVI - BEN C7 H8 N2 [H]/N=C(c1....
234 1J8A - BEN C7 H8 N2 [H]/N=C(c1....
235 6B6Q - BEN C7 H8 N2 [H]/N=C(c1....
236 1QB1 Ki = 170 nM 974 C28 H27 F2 N6 O5 Cn1ccnc1c2....
237 1O2W Ki = 1.4 uM 847 C18 H13 Br N4 O5 c1cc2c(cc1....
238 1XUF Ki = 0.09 uM BAZ C17 H16 N8 Zn [H]/N=C(c1....
239 1QBN Ki = 1400 nM 688 C22 H17 N5 O5 c1cc(cc(c1....
240 1O33 Ki = 1.8 uM 801 C13 H11 N5 O c1cc(c(nc1....
241 1V2O Ki = 18.45 uM ANH C20 H24 N4 O5 S Cc1ccc(cc1....
242 1C1N - BAM C7 H9 N2 c1ccc(cc1)....
243 1UTN Kd = 0.321 mM ABN C7 H9 N c1ccc(cc1)....
244 6SVD - BEN C7 H8 N2 [H]/N=C(c1....
245 6T0P Ki = 62 uM M6Q C20 H25 N5 O2 c1ccc(cc1)....
246 6SVW - BEN C7 H8 N2 [H]/N=C(c1....
247 4NA8 Ki = 1.5 nM 1T6 C31 H28 N4 O3 [H]/N=C(/c....
248 5WB6 Ki = 0.02 nM 9ZM C31 H26 Cl F N10 O4 COC(=O)Nc1....
249 5Q0H Ki = 12 nM 9F1 C27 H26 Cl F2 N5 O4 Cc1cc(c(c(....
250 5TKT Ki = 3.2 nM 7DS C28 H26 Cl N9 O4 COC(=O)Nc1....
251 4CRG - J4X C22 H18 N6 O [H]/N=C(c1....
252 5EXL Ki = 3.7 nM 5SS C28 H31 N5 O2 c1ccc(cc1)....
253 6TS5 ic50 = 0.003 uM NW2 C27 H29 N O5 CC(C)c1cc(....
254 6VLU Ki = 149.1 nM R2Y C27 H37 F2 N5 O2 CC(C)C[C@H....
255 5E2O Ki = 2 nM 5JM C26 H21 Cl N6 O4 c1ccc(cc1)....
256 4CRB Ki = 0.027 uM 7P0 C28 H24 Cl N7 O4 c1ccc(cc1)....
257 6TS6 ic50 = 0.004 uM NW5 C27 H26 N2 O4 CC(C)(C#N)....
258 5TKS Ki = 68 nM 7DL C29 H30 Cl2 N8 O3 COC(=O)Nc1....
259 5QTY Ki = 2.5 nM QLJ C32 H33 Cl N8 O5 CCOC(=O)[C....
260 5Q0E Ki = 0.69 nM 9FD C29 H30 Cl N9 O4 C[C@H]1CCC....
261 4CRE - MVN C10 H8 Cl N O CC1=CC(=O)....
262 4CRA Ki = 0.06 uM XJ8 C29 H25 N5 O4 c1ccc(cc1)....
263 1ZHR - BEN C7 H8 N2 [H]/N=C(c1....
264 5E2P Ki = 1.6 nM 7P0 C28 H24 Cl N7 O4 c1ccc(cc1)....
265 3BG8 - BEN C7 H8 N2 [H]/N=C(c1....
266 4X6P Ki = 5 nM 3YU C28 H23 Cl N10 O c1ccc(cc1)....
267 5Q0D Ki = 1 nM 9EY C27 H26 Cl N9 O4 COC(=O)Nc1....
268 4X6O Ki = 1.9 nM 3Y4 C29 H26 Cl2 N8 O3 COC(=O)Nc1....
269 5EXN Ki = 23 nM 5SU C31 H26 Cl N7 O3 COC(=O)Nc1....
270 4CR9 Ki = 80 uM OTW C10 H11 N3 Cc1cc(nc2c....
271 6TS4 ic50 = 2.8 uM J7B C22 H20 N2 O3 c1ccc(c(c1....
272 6USY Ki = 0.0004 uM QGS C28 H28 N2 O4 CC(C)c1cc(....
273 4CRC Ki = 0.0019 uM OTM C26 H21 Cl N10 O2 c1ccc(cc1)....
274 5QCL Ki = 11 nM BUY C27 H21 Cl N6 O4 c1ccc2c(c1....
275 1ZHM - BEN C7 H8 N2 [H]/N=C(c1....
276 5EXM Ki = 6.3 nM 5ST C29 H34 N4 O3 COC(=O)Nc1....
277 4TY7 Ki = 0.3 nM 39F C26 H30 Cl N7 O c1ccc(cc1)....
278 5QTT Ki = 3.4 nM QEY C30 H29 Cl F N7 O4 C[C@@H]1CC....
279 6W50 Ki = 0.3 nM SWP C31 H29 Cl F2 N4 O4 C[C@@H]1CC....
280 5QQP Ki = 5.3 nM NR7 C29 H30 Cl N5 O4 COC(=O)Nc1....
281 6C0S Ki = 89 nM EEJ C31 H31 Cl2 N9 O4 CC(=O)N1CC....
282 4CRF Ki = 0.0005 uM R9B C29 H23 Cl N4 O5 c1ccc(cc1)....
283 5QCN Ki = 6 nM BVM C36 H34 Cl N7 O7 CCOC(=O)[C....
284 6VLV Ki = 5.33 nM R3A C19 H25 Cl N6 O4 S [H]/N=C(/N....
285 5QTV Ki = 1.1 nM QLS C28 H27 Cl F3 N9 O3 COC(=O)Nc1....
286 4X6M Ki = 5.8 nM 3Y3 C27 H26 Cl2 N8 O c1ccc(cc1)....
287 5QTW Ki = 0.46 nM QLM C29 H30 Cl N9 O5 COC(=O)[C@....
288 4CR5 Ki = 70 uM 0TU C9 H6 Cl N O c1cc2c(cc1....
289 4CRD Ki = 0.08 uM OTJ C22 H22 Cl2 N8 O3 COC(=O)Nc1....
290 5QCM Ki = 110 nM BVJ C28 H23 Cl F N7 O4 COC(=O)Nc1....
291 5NB6 ic50 = 0.5 uM 8S2 C22 H21 F3 N6 O4 c1ccc2c(c1....
292 6FTY - E7H C20 H24 N4 O2 c1cc2c(cc(....
293 6QMR ic50 = 0.012 uM J6T C23 H23 N O4 c1ccc(c(c1....
294 5NAW ic50 = 0.05 uM 8RZ C23 H20 F3 N5 O4 c1ccc2c(c1....
295 5MT0 Kd ~ 500 uM QJS C19 H15 F N2 O3 c1ccc(cc1)....
296 6FUG Kd = 50 uM E85 C18 H17 N7 O c1cc(cc(c1....
297 5NAR ic50 = 0.5 uM 8RW C22 H20 F3 N5 O4 c1ccc2c(c1....
298 5FBE ic50 = 14 uM 5W5 C22 H22 F3 N3 O5 COC(=O)c1c....
299 6FUH Kd = 170 uM E88 C20 H23 N5 O2 CC(C)[C@@H....
300 5FBI Kd = 1600 uM 5WD C17 H14 N2 O4 c1cc(cc(c1....
301 6QMT ic50 = 0.12 uM J7B C22 H20 N2 O3 c1ccc(c(c1....
302 6FUT Kd = 20 uM E82 C24 H24 N2 O c1ccc2c(c1....
303 6FUJ ic50 = 120 uM E8B C18 H22 N2 O CC(C)CC(=O....
304 5FCK Kd = 0.006 uM 5WC C23 H22 Cl F N6 O3 C[C@H](c1c....
305 5NB7 ic50 = 0.006 uM 8NQ C21 H19 Br N6 O3 c1ccc2c(c1....
306 5MT4 Kd ~ 500 uM M7O C15 H14 N2 O3 c1ccc(cc1)....
307 5NBA ic50 = 0.05 uM 8S5 C22 H19 F4 N5 O4 c1ccc2c(c1....
308 6FUI Kd = 35 uM E7W C22 H25 N5 O2 c1ccc2c(c1....
309 6FTZ Kd = 1000 uM E7E C17 H16 N4 O2 c1cc(cc(c1....
310 6A8N Ki = 6.8 nM CYS PRO ALA TYR SER ARG TYR ILE GLY CYS n/a n/a
311 1ELC - 0Z3 C26 H34 F3 N4 O3 CC(C)c1ccc....
312 1ELD Ki = 0.2 uM 0Z0 C21 H19 F6 N3 O3 NULL
313 7EST - 0Z2 C18 H21 F6 N3 O3 CC(C)C[C@@....
314 2BD4 - LYS TYR PRO PHE VAL GLU PRO ILE n/a n/a
315 1ELB Ki = 70 nM 0Z4 C23 H36 F3 N4 O3 CC(C)C[C@@....
316 6TH7 ic50 = 1.18 nM O4Q 5XU ABA ILE ABA VAL N9K PHA AA4 n/a n/a
317 1ELE Ki = 0.14 uM 0QN C17 H19 F6 N3 O3 NULL
318 4GVU ic50 = 30 nM 6NA GLN THR DBU GLJ PHE YNM VAL n/a n/a
319 1NES - ACE ALA PRO ALA n/a n/a
320 2BDB - ALA ALA n/a n/a
321 1BMA Ki = 26 uM 0QH C27 H36 F3 N4 O3 NULL
322 2EST - 2Z5 C18 H23 F6 N4 O3 NULL
323 1ELA Ki = 0.44 uM 0Z1 C22 H32 F3 N4 O3 CC(C)c1ccc....
324 1QR3 ic50 = 0.26 uM ALQ CIR THR DBU GLJ PHE TYJ VAL n/a n/a
325 1BIT - BEN C7 H8 N2 [H]/N=C(c1....
326 1HJ8 - BAM C7 H9 N2 c1ccc(cc1)....
327 1UTL Ka = 293 M^-1 PRA C9 H13 N c1ccc(cc1)....
328 2TBS - BEN C7 H8 N2 [H]/N=C(c1....
329 2ZPQ - BEN C7 H8 N2 [H]/N=C(c1....
330 1UTJ Kd = 0.144 mM ABN C7 H9 N c1ccc(cc1)....
331 1UTM Ka = 243 M^-1 PEA C8 H12 N c1ccc(cc1)....
332 1MBQ - BEN C7 H8 N2 [H]/N=C(c1....
333 2ZPS - BEN C7 H8 N2 [H]/N=C(c1....
334 2ZPR - BEN C7 H8 N2 [H]/N=C(c1....
335 1L2E - BEN C7 H8 N2 [H]/N=C(c1....
336 3VFE - 0HL C26 H26 N4 O4 S3 [H]/N=C(c1....
337 6QH9 - J3B C13 H16 N4 O2 [H]/N=C(/c....
338 6QFH ic50 = 1.38 uM J08 C23 H22 N6 O [H]/N=C(/c....
339 6QHB - J2W C15 H15 N3 O3 [H]/N=C(/c....
340 6SKC - BEN C7 H8 N2 [H]/N=C(c1....
341 1LO6 - BEN C7 H8 N2 [H]/N=C(c1....
342 6QFF ic50 = 2.04 uM J08 C23 H22 N6 O [H]/N=C(/c....
343 6QHC - 135 C14 H13 N3 O2 [H]/N=C(c1....
344 4D8N ic50 = 1.8 uM 0HM C24 H24 N5 O2 c1ccc(cc1)....
345 6QFG ic50 = 3.01 uM J08 C23 H22 N6 O [H]/N=C(/c....
346 6QHA - J2Q C16 H17 N3 O3 [H]/N=C(/c....
347 3P8G - BEN C7 H8 N2 [H]/N=C(c1....
348 1EAX - BEN C7 H8 N2 [H]/N=C(c1....
349 2GV6 Ki = 0.046 uM 730 C28 H35 N7 O3 S [H]/N=C(c1....
350 4R0I Ki = 0.3 uM 3KM C27 H33 N5 O4 S [H]/N=C(c1....
351 4O97 Ki = 3 nM NTX C29 H34 N6 O3 [H]/N=C(N)....
352 2GV7 Ki = 0.014 uM 672 C36 H54 N8 O4 S [H]/N=C(c1....
353 4O9V Ki = 10 nM NT4 C27 H30 N6 O3 [H]/N=C(N)....
354 1IAU Ki = 80 nM ACE ILE GLU PRO ASJ n/a n/a
355 1ANE - BEN C7 H8 N2 [H]/N=C(c1....
356 1J16 Ki = 143 uM BEN C7 H8 N2 [H]/N=C(c1....
357 1J14 Ki = 32.2 uM BEN C7 H8 N2 [H]/N=C(c1....
358 1BRA Ki = 15000 uM BEN C7 H8 N2 [H]/N=C(c1....
359 1J15 Ki = 143 uM BEN C7 H8 N2 [H]/N=C(c1....
360 1TRM - BEN C7 H8 N2 [H]/N=C(c1....
361 1J17 Ki = 6.05 uM ZEN C25 H27 Cl N4 O3 S c1cc(cc2c1....
362 1ANC - BEN C7 H8 N2 [H]/N=C(c1....
363 1QL9 Ki = 4.45 uM ZEN C25 H27 Cl N4 O3 S c1cc(cc2c1....
364 1DPO - BEN C7 H8 N2 [H]/N=C(c1....
365 1AND - BEN C7 H8 N2 [H]/N=C(c1....
366 1W0Z Ki = 21 nM SI1 C18 H29 N5 O5 S [H]/N=C(c1....
367 4ZHL Kd = 0.0147 uM CYS PRO ALA TYR SER ARG TYR ILE GLY CYS n/a n/a
368 2VIV ic50 = 520 nM VG2 C22 H28 Cl N3 O2 Cc1cc(cc(c....
369 1SC8 Ki = 0.036 uM 2IN C20 H25 N5 O5 S c1ccc(cc1)....
370 1OWE Ki = 0.631 uM 675 C18 H15 N3 O [H]/N=C(/c....
371 4X1Q - CYS PRO ALA TYR SER ARG TYR LEU ASP CYS n/a n/a
372 2VIP ic50 = 5.2 uM L1R C18 H20 Cl2 N2 O3 CC(C)Oc1cc....
373 5ZAF Ki = 166 nM 28I C16 H21 N7 O2 [H]/N=C(N)....
374 1SQT Ki = 0.63 uM UI3 C16 H16 N4 O3 S [H]/N=C(/c....
375 1W13 Ki = 2 nM SM1 C21 H28 N6 O5 S [H]/N=C(/N....
376 1OWH Ki = 40 nM 239 C19 H18 N4 O [H]/N=C(/c....
377 1EJN Ki = 2.4 uM AGB C19 H27 N5 O [H]/N=C(/N....
378 4ZHM Kd = 0.00081 uM MRZ CYS PRO ALA TYR SER ALA TYR ILE GLY CYS n/a n/a
379 2VIN ic50 > 1 mM 505 C11 H17 N O Cc1cccc(c1....
380 5ZA8 Ki = 508 nM 27I C16 H23 N9 O [H]/N=C(/N....
381 5ZA7 Ki = 1356 nM HMX C12 H18 Cl N7 O C1CCCN(CC1....
382 4X0W - MRZ CYS PRO ALA TYR SER DAL TYR LEU ASP CYS n/a n/a
383 1U6Q - 745 C20 H18 N2 [H]/N=C(/c....
384 5ZA9 Ki = 183 nM 50I C20 H23 N7 O2 [H]/N=C(/N....
385 2VIQ ic50 = 1.3 uM D55 C21 H28 N2 O4 CCOc1ccc(c....
386 4X1P - CYS PRO ALA TYR SER DAL TYR LEU ASP CYS MRZ n/a n/a
387 6NMB Ki = 2.01 mM AMH C8 H15 N O2 C1CC(CCC1C....
388 5ZAG Ki = 108 nM 94I C16 H21 N9 O [H]/N=C(N)....
389 5ZC5 Ki = 88 nM 09I C20 H22 F N7 O2 [H]/N=C(/N....
390 1VJ9 Ki = 0.028 uM 5IN C28 H33 N5 O6 S c1ccc(cc1)....
391 1F5K Ki = 180 uM BAM C7 H9 N2 c1ccc(cc1)....
392 5ZAE Ki = 156 nM EAU C16 H21 N7 O2 [H]/N=C(/N....
393 1OWD Ki = 6.3 nM 497 C23 H24 N4 O CC[C@H]1CN....
394 2VNT Ki = 9.9 nM QGG C15 H16 Cl N5 O4 S c1cc2c(cc1....
395 2VIO ic50 = 40 uM L1O C9 H9 Cl2 N O3 c1c(cc(c(c....
396 1F5L Ki = 5.3 uM AMR C6 H8 Cl N7 O c1(c(nc(c(....
397 5ZAJ Ki = 42 nM 32I C18 H25 N9 O3 [H]/N=C(/N....
398 2R2W Ki = 34 uM 4PG C15 H15 N3 O [H]/N=C(/N....
399 2VIW ic50 = 72 nM D56 C24 H32 Cl N3 O3 CCOc1c(cc(....
400 1W11 Ki = 6 nM SK1 C21 H27 N5 O5 S [H]/N=C(c1....
401 1SQA Ki = 0.00062 uM UI1 C23 H21 N7 O c1cnc(nc1)....
402 1VJA Ki = 0.02 uM 7IN C21 H27 N5 O6 S c1ccc(cc1)....
403 1SQO Ki = 0.035 uM UI2 C15 H13 N5 c1cc2ccc(c....
404 1GDN - GLY ALA LYS n/a n/a
405 1FY5 - GLY ALA LYS n/a n/a
406 1FY4 - GLY ALA ARG n/a n/a
407 1PQ8 - GLY GLY ARG n/a n/a
408 1FN8 - GLY ALA ARG n/a n/a
409 1PQ7 - ARG C6 H15 N4 O2 C(C[C@@H](....
410 1PQ5 - ARG C6 H15 N4 O2 C(C[C@@H](....
411 1H4W Ki = 22 uM BEN C7 H8 N2 [H]/N=C(c1....
412 5TP0 Ki = 3.66 uM BRN C14 H15 N7 c1cc(ccc1C....
413 1T32 Ki = 38 nM OHH C40 H35 N2 O6 P CN(C1CCN(C....
414 4K60 ic50 = 570 uM 1P8 C8 H6 Br N O c1cc2c(cc1....
415 1T31 Ki = 2.3 nM OHH C40 H35 N2 O6 P CN(C1CCN(C....
416 4K5Z - 1P7 C8 H6 Cl N O c1cc2c(cc1....
417 3N7O Ki = 72 nM N7O C19 H15 Cl F2 N O3 P S C[P@@](=O)....
418 3S0N ic50 = 180 nM 0BB C21 H20 N2 O3 S Cc1cccc2c1....
419 5YJM Kd = 0.000000064 M 8W3 C30 H32 Cl N5 O6 CC[C@H](c1....
420 4K2Y ic50 = 470 uM ES2 C8 H6 Cl N O c1cc2c(cc1....
421 5YJP ic50 = 0.24 uM 8W6 C26 H31 Cl N4 O6 CC[C@H](c1....
422 4K69 ic50 = 0.04 uM 1P9 C22 H22 Br N3 O4 CCC[C@@H](....
423 1OSS Ki = 16.4 uM BEN C7 H8 N2 [H]/N=C(c1....
424 3BEU - BEN C7 H8 N2 [H]/N=C(c1....
425 5XWL - ACE THR ARG GLU n/a n/a
426 5XWJ - ACE THR ARG GLU n/a n/a
427 1V6D - PRO ASP AIB LEU AIB LEU ALA TBF NME n/a n/a
428 1YF4 Ki = 5 nM CYS TYR PHE GLN ASN CYS PRO ARG GLY NH2 n/a n/a
429 1S6H - 4BZ C8 H10 N2 O [H]/N=C(c1....
430 1S83 - 4HA C4 H12 N O C(CCO)C[NH....
431 1S5S - PG3 C4 H12 N3 O C(CNC(=[NH....
432 5A09 ic50 = 3.5 nM JJD C23 H18 F3 N3 O4 CC1=C([C@H....
433 5A8X ic50 = 6.5 nM IUY C24 H20 F3 N4 O2 CCOC(=O)C1....
434 5ABW ic50 = 17 nM WQQ C26 H24 Cl N3 O5 S Cc1c(c(on1....
435 5A8Y ic50 = 0.17 nM VBM C23 H16 F3 N7 O2 CC1=C([C@H....
436 5A0B ic50 = 5 nM JJX C29 H29 F3 N6 O2 CC1=C([C@H....
437 5A8Z ic50 = 28 nM IUL C21 H16 F3 N5 O2 CN1CC2=C([....
438 3Q77 ic50 = 6 nM 2HY C22 H18 F3 N3 O4 CC1=C([C@H....
439 5A0C ic50 = 0.54 nM JJV C21 H15 F3 N4 O3 S CC1=C([C@H....
440 5A0A Ki = 15 nM JJS C20 H15 F3 N4 O2 CC1=C([C@H....
441 2AIQ - BEN C7 H8 N2 [H]/N=C(c1....
442 2OQ5 - BEN C7 H8 N2 [H]/N=C(c1....
443 5F03 - 5TA C24 H20 Cl N3 O3 c1cc(cc(c1....
444 2ZA5 Ki = 3.7 nM 2FF C26 H24 N2 O3 c1ccc(cc1)....
445 2FPZ Ki = 110 uM 270 C7 H7 N3 C1=CC2=NC(....
446 2BM2 Ki = 15 nM PM2 C26 H29 N3 O c1ccc(cc1)....
447 3V7T Ki = 62 nM 0GX C23 H28 Br F N2 O2 S CCCOc1c(c(....
448 2ZEB - 11M C23 H24 N2 O2 S2 CSc1c2cccc....
449 4A6L Ki = 10 nM P43 C25 H23 F N2 O2 c1ccc(c(c1....
450 2ZEC - 11N C22 H24 N2 O2 c1ccc(cc1)....
451 4NFE - BEN C7 H8 N2 [H]/N=C(c1....
452 2ANW - BAM C7 H9 N2 c1ccc(cc1)....
453 2ANY - BAM C7 H9 N2 c1ccc(cc1)....
454 5TJX - GBT C29 H33 N7 O3 Cc1c2c(cc(....
455 6O1S - 7SD C23 H25 N7 O Cc1cc(nc(c....
456 6T7P Ki = 0.97 uM MU8 C26 H24 Cl N3 O3 c1ccc(cc1)....
457 6QFE ic50 = 0.08 uM J08 C23 H22 N6 O [H]/N=C(/c....
458 6B74 - BEN C7 H8 N2 [H]/N=C(c1....
459 1A0J - BEN C7 H8 N2 [H]/N=C(c1....
460 2ZGJ - SER SER GLY LYS VAL PRO LEU SER n/a n/a
461 2ZGH - SER SER GLY LYS VAL PRO LEU n/a n/a
462 2BDG - PBZ C7 H10 N3 c1cc(ccc1C....
463 5Y9L ic50 = 1.9 uM 8R3 C24 H28 Cl N5 O5 CN(C)/N=C1....
464 5YJK ic50 = 0.82 uM 8VX C24 H30 Cl N5 O5 S CN(C)/N=C1....
465 5FAH ic50 = 0.7 uM 5VT C26 H29 N3 O3 COc1ccc(cc....
466 3TJV - PRO THR SER TYR ALA GLY ASP ASP SER GLY n/a n/a
467 6AHS ic50 = 1.5 uM 9YO C19 H18 Cl N3 O2 S Cc1ccc2c(c....
468 5ZFI ic50 = 1.2 uM 9C9 C26 H29 Cl2 N7 O2 Cn1cc(cn1)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: AMH; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 AMH 1 1
2 L14 0.52 0.615385
Similar Ligands (3D)
Ligand no: 1; Ligand: AMH; Similar ligands found: 904
No: Ligand Similarity coefficient
1 PNZ 1.0000
2 ANN 0.9974
3 BPN 0.9880
4 259 0.9846
5 E5X 0.9840
6 PHB 0.9801
7 NPO 0.9780
8 Z82 0.9777
9 4NM 0.9774
10 PAB 0.9754
11 4MA 0.9738
12 PBZ 0.9728
13 RNO 0.9694
14 PZM 0.9691
15 SN4 0.9678
16 AC6 0.9670
17 SNO 0.9668
18 A7N 0.9643
19 1M2 0.9619
20 XIY 0.9616
21 8WO 0.9610
22 1Y6 0.9606
23 LQ2 0.9601
24 TSU 0.9595
25 HBD 0.9592
26 M4S 0.9587
27 2BG 0.9575
28 5XC 0.9563
29 S7J 0.9538
30 FBF 0.9537
31 DOB 0.9525
32 SW7 0.9524
33 FA0 0.9521
34 N2I 0.9517
35 LR5 0.9516
36 1F1 0.9514
37 6NT 0.9504
38 0HN 0.9500
39 KBZ 0.9490
40 I3E 0.9487
41 6NI 0.9486
42 4M0 0.9483
43 4BZ 0.9478
44 4WL 0.9471
45 12T 0.9469
46 JB8 0.9469
47 0HO 0.9467
48 ESX 0.9467
49 JDN 0.9463
50 4J8 0.9461
51 7A8 0.9460
52 HDH 0.9449
53 4JC 0.9446
54 3NY 0.9445
55 449 0.9444
56 3A9 0.9440
57 BHA 0.9439
58 OTR 0.9437
59 2ZM 0.9437
60 4NZ 0.9435
61 4CM 0.9433
62 8ZE 0.9433
63 6KT 0.9432
64 4YO 0.9431
65 717 0.9430
66 428 0.9427
67 TYL 0.9427
68 FCR 0.9412
69 J6W 0.9412
70 5CU 0.9410
71 HBA 0.9408
72 H8N 0.9406
73 SAN 0.9405
74 AKG 0.9402
75 FBS 0.9398
76 86L 0.9394
77 4NB 0.9393
78 1P8 0.9393
79 826 0.9391
80 RNT 0.9390
81 AMS 0.9387
82 BZ2 0.9384
83 AAS 0.9383
84 DHB 0.9383
85 4NC 0.9382
86 4P5 0.9381
87 BZ3 0.9381
88 AM4 0.9380
89 MR1 0.9375
90 ESP 0.9374
91 MSR 0.9368
92 IHB 0.9367
93 INO 0.9367
94 CHB 0.9366
95 P9P 0.9363
96 DE5 0.9363
97 6FZ 0.9362
98 4JL 0.9361
99 94W 0.9358
100 IPB 0.9354
101 Z13 0.9352
102 E7S 0.9352
103 4JQ 0.9349
104 174 0.9344
105 YRL 0.9341
106 C2B 0.9340
107 4AA 0.9338
108 CPZ 0.9335
109 4ZA 0.9335
110 3W8 0.9329
111 ICB 0.9328
112 CWJ 0.9328
113 4VP 0.9327
114 ES2 0.9321
115 2A9 0.9317
116 DVQ 0.9316
117 F4E 0.9315
118 93K 0.9312
119 ABI 0.9310
120 0JD 0.9307
121 F4K 0.9306
122 SNU 0.9306
123 GOJ 0.9304
124 XM0 0.9302
125 2HO 0.9299
126 ODO 0.9293
127 PPY 0.9290
128 MS9 0.9286
129 FQI 0.9285
130 4JE 0.9285
131 9TW 0.9283
132 5LA 0.9282
133 3BU 0.9281
134 RNS 0.9277
135 5NU 0.9277
136 4FA 0.9276
137 C1M 0.9275
138 MYJ 0.9275
139 QSB 0.9274
140 15E 0.9272
141 HSO 0.9272
142 AEF 0.9270
143 KJU 0.9269
144 4HP 0.9267
145 36E 0.9260
146 15N 0.9255
147 K2T 0.9248
148 SYV 0.9248
149 JAW 0.9246
150 RB5 0.9245
151 XYL 0.9245
152 LNO 0.9245
153 5NI 0.9242
154 4BY 0.9242
155 FBB 0.9241
156 XX2 0.9236
157 HC4 0.9235
158 2FY 0.9232
159 FBA 0.9232
160 S0E 0.9232
161 4RU 0.9231
162 AES 0.9231
163 3DM 0.9230
164 3V4 0.9229
165 4Z4 0.9229
166 CLW 0.9228
167 LDP 0.9220
168 AEG 0.9219
169 TZF 0.9219
170 TH7 0.9219
171 GJP 0.9217
172 MAJ 0.9214
173 1HN 0.9210
174 SME 0.9209
175 HX4 0.9209
176 9ZE 0.9208
177 YI6 0.9207
178 S2G 0.9205
179 NF3 0.9203
180 8H8 0.9202
181 GUA 0.9202
182 36Y 0.9201
183 ISZ 0.9198
184 1FD 0.9197
185 BNF 0.9196
186 FUD 0.9193
187 EVF 0.9192
188 NIZ 0.9192
189 5OB 0.9191
190 98J 0.9190
191 X0V 0.9190
192 4JM 0.9185
193 HMH 0.9184
194 9FL 0.9183
195 K4V 0.9182
196 SOR 0.9180
197 IFP 0.9173
198 7WG 0.9173
199 A5E 0.9171
200 L99 0.9167
201 TGX 0.9167
202 J9T 0.9166
203 BCU 0.9165
204 DZA 0.9165
205 H42 0.9165
206 DHS 0.9162
207 IXW 0.9161
208 UNJ 0.9160
209 RAT 0.9156
210 LNR 0.9153
211 IWT 0.9153
212 HYP 0.9152
213 BZX 0.9151
214 VGD 0.9149
215 2QC 0.9147
216 PBA 0.9145
217 14J 0.9143
218 ZYX 0.9140
219 36R 0.9138
220 ONH 0.9138
221 SSC 0.9134
222 3ZB 0.9134
223 BHO 0.9132
224 TAR 0.9131
225 1SA 0.9129
226 4JT 0.9129
227 5XB 0.9126
228 9R5 0.9125
229 J9Q 0.9125
230 268 0.9124
231 ET2 0.9123
232 DHR 0.9120
233 JND 0.9120
234 KOJ 0.9119
235 OW4 0.9118
236 CFI 0.9118
237 3PF 0.9116
238 RBL 0.9115
239 5GU 0.9114
240 XRG 0.9111
241 97T 0.9110
242 KDV 0.9110
243 27B 0.9110
244 UA5 0.9108
245 BEN 0.9108
246 XUL 0.9107
247 MET 0.9107
248 TTL 0.9106
249 MTL 0.9106
250 GWM 0.9103
251 MAH 0.9103
252 HIS 0.9103
253 PH3 0.9102
254 FBM 0.9096
255 P72 0.9095
256 F9Y 0.9095
257 MUC 0.9094
258 FYU 0.9094
259 B57 0.9093
260 MQN 0.9092
261 069 0.9091
262 5VM 0.9090
263 GLN 0.9089
264 3HG 0.9089
265 4SX 0.9089
266 BDP 0.9087
267 DJN 0.9086
268 EUE 0.9086
269 MPV 0.9079
270 KMH 0.9079
271 FA1 0.9078
272 HHH 0.9078
273 DEW 0.9077
274 HMU 0.9076
275 2FT 0.9076
276 CN0 0.9075
277 54Z 0.9075
278 0TU 0.9074
279 4FH 0.9074
280 A7H 0.9074
281 CTL 0.9074
282 2HU 0.9073
283 A29 0.9073
284 SRT 0.9072
285 I3A 0.9070
286 5FX 0.9068
287 9J3 0.9067
288 PHU 0.9064
289 P9E 0.9063
290 BQ2 0.9061
291 FHB 0.9061
292 OVM 0.9061
293 FOC 0.9060
294 2BX 0.9059
295 SLS 0.9058
296 4XV 0.9057
297 92K 0.9057
298 RHU 0.9057
299 PBC 0.9056
300 ES5 0.9056
301 EPR 0.9055
302 TAG 0.9055
303 LFC 0.9054
304 PSJ 0.9054
305 K82 0.9052
306 4FS 0.9052
307 EKZ 0.9050
308 DGN 0.9048
309 DGJ 0.9047
310 0FN 0.9046
311 KTW 0.9046
312 M45 0.9045
313 2AQ 0.9044
314 AX7 0.9044
315 LLH 0.9044
316 88L 0.9043
317 K34 0.9043
318 SEP 0.9042
319 BEZ 0.9041
320 24B 0.9040
321 OVP 0.9037
322 TCA 0.9037
323 3HM 0.9037
324 NFM 0.9037
325 5QY 0.9036
326 NSP 0.9035
327 GO2 0.9035
328 BAM 0.9034
329 LPK 0.9031
330 5QX 0.9028
331 9FE 0.9027
332 80G 0.9024
333 PIM 0.9024
334 OGA 0.9023
335 J9N 0.9023
336 CCU 0.9023
337 4XS 0.9023
338 R9Y 0.9022
339 NCA 0.9022
340 TWO 0.9022
341 X0U 0.9016
342 HQJ 0.9016
343 PKU 0.9016
344 AZM 0.9016
345 VC3 0.9015
346 ZZT 0.9015
347 GLU 0.9015
348 UNU 0.9014
349 4A3 0.9012
350 4VY 0.9012
351 8K2 0.9010
352 03V 0.9006
353 OCH 0.9006
354 ESI 0.9006
355 SSB 0.9005
356 JA8 0.9005
357 ZEC 0.9005
358 NNO 0.9004
359 ASO 0.9004
360 NIO 0.9003
361 4I8 0.9002
362 QMP 0.9001
363 AAN 0.8998
364 2HG 0.8998
365 N4E 0.8997
366 7N0 0.8997
367 3AE 0.8997
368 OQC 0.8996
369 OOG 0.8995
370 5RO 0.8992
371 LYS 0.8990
372 COU 0.8990
373 492 0.8990
374 SOL 0.8990
375 IAC 0.8989
376 OAA 0.8988
377 1L5 0.8988
378 E7Z 0.8988
379 HX3 0.8988
380 GGL 0.8987
381 TSS 0.8987
382 4XR 0.8986
383 SKM 0.8986
384 3VX 0.8986
385 92P 0.8985
386 K97 0.8985
387 JAE 0.8984
388 AL0 0.8984
389 BNL 0.8984
390 TIH 0.8983
391 N91 0.8982
392 6PC 0.8982
393 OKG 0.8982
394 7O4 0.8982
395 KMY 0.8981
396 XIZ 0.8980
397 2FX 0.8978
398 G3P 0.8977
399 SKF 0.8977
400 MRZ 0.8975
401 363 0.8974
402 DHI 0.8974
403 W81 0.8974
404 4TU 0.8971
405 QSH 0.8971
406 GLO 0.8970
407 OW7 0.8969
408 GJZ 0.8968
409 GDE 0.8968
410 173 0.8966
411 EHM 0.8965
412 6RQ 0.8964
413 ZXD 0.8964
414 XXP 0.8964
415 PJW 0.8963
416 8WT 0.8963
417 F9P 0.8962
418 13P 0.8957
419 ABV 0.8957
420 HA5 0.8955
421 KTA 0.8955
422 PFL 0.8953
423 ST3 0.8953
424 7VP 0.8952
425 3M0 0.8952
426 NYL 0.8951
427 PIY 0.8951
428 PHE 0.8950
429 4BL 0.8949
430 3R4 0.8948
431 CXF 0.8947
432 PZA 0.8947
433 FDR 0.8945
434 EN1 0.8945
435 G3H 0.8945
436 CUW 0.8944
437 P4B 0.8944
438 S24 0.8943
439 HNK 0.8943
440 GXY 0.8941
441 RBJ 0.8940
442 NDH 0.8940
443 PGH 0.8938
444 BML 0.8938
445 HCI 0.8938
446 CIT 0.8935
447 DHK 0.8935
448 PAC 0.8933
449 3VS 0.8933
450 2EC 0.8931
451 4LW 0.8930
452 OK7 0.8930
453 GAB 0.8929
454 NGA 0.8929
455 DHC 0.8928
456 2F6 0.8926
457 NAG 0.8926
458 PZI 0.8926
459 QX4 0.8925
460 FAN 0.8925
461 1DV 0.8925
462 8NB 0.8925
463 2MI 0.8925
464 E79 0.8924
465 N1E 0.8924
466 FK8 0.8924
467 RA7 0.8924
468 M3H 0.8923
469 DBH 0.8923
470 R20 0.8922
471 2AL 0.8921
472 ALE 0.8919
473 E1T 0.8919
474 HMS 0.8918
475 42J 0.8918
476 TT4 0.8918
477 F1A 0.8917
478 BZJ 0.8916
479 3HA 0.8915
480 11S 0.8913
481 HNL 0.8913
482 NOY 0.8913
483 F02 0.8912
484 PO6 0.8912
485 MLT 0.8912
486 270 0.8911
487 2KA 0.8910
488 HHI 0.8908
489 NOK 0.8908
490 YZM 0.8907
491 URC 0.8907
492 TYE 0.8906
493 JTH 0.8906
494 XCG 0.8905
495 BNS 0.8904
496 FIX 0.8901
497 ICO 0.8900
498 263 0.8899
499 PQK 0.8899
500 AHR 0.8899
501 YCP 0.8898
502 BE2 0.8897
503 0F9 0.8897
504 TLA 0.8896
505 KTJ 0.8896
506 SD4 0.8895
507 4NS 0.8895
508 QY9 0.8893
509 2HC 0.8892
510 IFL 0.8890
511 R9S 0.8890
512 URP 0.8889
513 DQU 0.8888
514 M4T 0.8887
515 IV2 0.8885
516 RSO 0.8884
517 152 0.8884
518 HNH 0.8884
519 XQ0 0.8883
520 XAZ 0.8882
521 P7Y 0.8882
522 7MW 0.8880
523 E4P 0.8880
524 QSC 0.8880
525 8OZ 0.8879
526 EYV 0.8878
527 Q07 0.8877
528 RD4 0.8877
529 SKA 0.8877
530 PCA 0.8876
531 BSX 0.8875
532 N2Z 0.8875
533 LYL 0.8874
534 A2G 0.8874
535 GF4 0.8872
536 7MU 0.8870
537 TYR 0.8869
538 8TX 0.8869
539 1A7 0.8867
540 OHJ 0.8867
541 CS2 0.8865
542 UFV 0.8865
543 SAL 0.8865
544 ILE 0.8865
545 LT2 0.8865
546 GAL 0.8864
547 H4N 0.8863
548 BP9 0.8863
549 NOJ 0.8862
550 VNL 0.8861
551 PD2 0.8861
552 GNM 0.8860
553 0BP 0.8860
554 1Z6 0.8860
555 L5V 0.8859
556 ADA 0.8858
557 8NY 0.8858
558 5RN 0.8858
559 JB5 0.8854
560 4NP 0.8854
561 D48 0.8852
562 2LP 0.8852
563 SS1 0.8852
564 3W3 0.8852
565 3W6 0.8852
566 YPN 0.8851
567 FLC 0.8849
568 G2F 0.8849
569 FK1 0.8849
570 258 0.8848
571 2HQ 0.8847
572 HHR 0.8846
573 61M 0.8844
574 14O 0.8844
575 PRF 0.8844
576 GP9 0.8843
577 GZQ 0.8843
578 XYH 0.8842
579 HFA 0.8842
580 92G 0.8842
581 N3W 0.8841
582 7UC 0.8840
583 MEV 0.8839
584 5MI 0.8839
585 L22 0.8837
586 15L 0.8836
587 GLL 0.8835
588 PH2 0.8835
589 GLC 0.8835
590 TIU 0.8835
591 2GS 0.8835
592 DA4 0.8834
593 3C4 0.8833
594 F31 0.8832
595 ES9 0.8832
596 NCT 0.8830
597 URS 0.8829
598 SS2 0.8828
599 BBK 0.8827
600 SOE 0.8827
601 B62 0.8825
602 6VD 0.8825
603 ZBT 0.8824
604 PEA 0.8824
605 LMR 0.8824
606 8NX 0.8824
607 M2K 0.8824
608 1CO 0.8824
609 HHA 0.8823
610 5WV 0.8823
611 PNP 0.8823
612 IOS 0.8822
613 7W1 0.8822
614 TPA 0.8822
615 C2Y 0.8820
616 6ME 0.8820
617 ASP 0.8820
618 SHA 0.8820
619 EXD 0.8819
620 52C 0.8818
621 0FK 0.8818
622 F60 0.8817
623 JKE 0.8817
624 44V 0.8812
625 GLY GLY 0.8812
626 MNM 0.8811
627 FF2 0.8811
628 QBK 0.8810
629 5MB 0.8810
630 2K4 0.8809
631 GVM 0.8808
632 VOH 0.8807
633 261 0.8805
634 HL5 0.8804
635 5H1 0.8804
636 RM1 0.8804
637 TPO 0.8803
638 9CA 0.8802
639 4CH 0.8802
640 URO 0.8802
641 36M 0.8801
642 I1E 0.8801
643 4JU 0.8800
644 6AI 0.8800
645 H5B 0.8800
646 11C 0.8800
647 SNE 0.8799
648 CH9 0.8799
649 0VT 0.8797
650 GTR 0.8795
651 GCU 0.8794
652 DHY 0.8794
653 86J 0.8793
654 XBT 0.8793
655 PEL 0.8792
656 AC0 0.8790
657 LCN 0.8789
658 6TZ 0.8788
659 OEG 0.8788
660 ACA 0.8787
661 82I 0.8785
662 67N 0.8784
663 FGZ 0.8781
664 GCO 0.8780
665 X1R 0.8780
666 3S5 0.8779
667 3PG 0.8779
668 PXY 0.8779
669 DYA 0.8778
670 B53 0.8777
671 PQ0 0.8777
672 G3E 0.8777
673 C53 0.8776
674 FOM 0.8776
675 A65 0.8774
676 CFA 0.8773
677 9NB 0.8773
678 ASC 0.8771
679 ENO 0.8771
680 PMB 0.8771
681 FP1 0.8771
682 KYA 0.8770
683 5WZ 0.8769
684 PEP 0.8769
685 12Q 0.8769
686 ES6 0.8768
687 GDL 0.8766
688 XXG 0.8763
689 QIC 0.8763
690 3HB 0.8763
691 FHC 0.8762
692 56D 0.8761
693 3F0 0.8760
694 3XR 0.8760
695 3U4 0.8760
696 RMN 0.8759
697 4MB 0.8758
698 AG2 0.8758
699 FBJ 0.8758
700 AHB 0.8756
701 HIC 0.8756
702 AN3 0.8754
703 0NX 0.8752
704 2IT 0.8748
705 I4B 0.8748
706 KMT 0.8747
707 VGL 0.8747
708 ES7 0.8746
709 4SV 0.8745
710 HL4 0.8744
711 OHP 0.8744
712 THE 0.8744
713 IDH 0.8744
714 GVG 0.8743
715 2AS 0.8743
716 FEH 0.8743
717 K3D 0.8742
718 KKN 0.8742
719 NDG 0.8741
720 J5I 0.8741
721 6SD 0.8740
722 1IT 0.8737
723 ISN 0.8736
724 BGC 0.8736
725 3SK 0.8735
726 2MH 0.8735
727 TMG 0.8734
728 SE2 0.8733
729 MZT 0.8733
730 K7M 0.8733
731 H4E 0.8731
732 GLA 0.8731
733 4LV 0.8730
734 P81 0.8729
735 IF7 0.8726
736 44W 0.8725
737 R2P 0.8724
738 PCS 0.8722
739 2O6 0.8722
740 DMD 0.8722
741 LDU 0.8721
742 535 0.8719
743 NLE 0.8718
744 R2B 0.8718
745 HHT 0.8717
746 3OC 0.8717
747 NFA 0.8716
748 ORN 0.8716
749 OHG 0.8716
750 PXL 0.8715
751 HY1 0.8715
752 DMJ 0.8715
753 1AB 0.8711
754 3SL 0.8710
755 GAF 0.8710
756 ARW 0.8709
757 B85 0.8708
758 P80 0.8705
759 M1A 0.8703
760 DGL 0.8702
761 X6X 0.8701
762 XLS 0.8700
763 HPN 0.8700
764 PPT 0.8699
765 FA3 0.8699
766 G4D 0.8698
767 DQA 0.8698
768 FBV 0.8698
769 7W4 0.8697
770 HPS 0.8696
771 9RW 0.8695
772 68A 0.8693
773 XDE 0.8692
774 B40 0.8689
775 JLZ 0.8689
776 COI 0.8688
777 53C 0.8688
778 N2M 0.8686
779 DNA 0.8684
780 VXX 0.8683
781 MZW 0.8682
782 C82 0.8682
783 EVA 0.8681
784 AOT 0.8679
785 46P 0.8678
786 23J 0.8677
787 QWN 0.8677
788 FB2 0.8677
789 A7W 0.8677
790 41K 0.8676
791 HQT 0.8676
792 M1T 0.8675
793 5JQ 0.8673
794 FB1 0.8673
795 49F 0.8671
796 2D0 0.8671
797 PBN 0.8669
798 PRY 0.8669
799 SWX 0.8668
800 7WV 0.8668
801 OTW 0.8668
802 LEU 0.8667
803 F81 0.8667
804 DAS 0.8667
805 TEO 0.8666
806 GYE 0.8665
807 ST2 0.8665
808 S8V 0.8665
809 45L 0.8663
810 Q02 0.8661
811 9SE 0.8659
812 SMN 0.8658
813 N8Y 0.8657
814 BHQ 0.8657
815 75K 0.8657
816 D3G 0.8655
817 EE8 0.8654
818 3DO 0.8653
819 DPN 0.8652
820 3YP 0.8650
821 GXL 0.8650
822 Z5P 0.8648
823 GPF 0.8647
824 BDF 0.8647
825 XHP 0.8646
826 QXW 0.8646
827 ASN 0.8645
828 DEZ 0.8644
829 ACH 0.8643
830 CEE 0.8639
831 3QM 0.8637
832 4XF 0.8635
833 271 0.8634
834 KJY 0.8633
835 8EZ 0.8633
836 5VL 0.8633
837 GCB 0.8633
838 M58 0.8632
839 3AB 0.8631
840 EOU 0.8630
841 GVY 0.8628
842 2O8 0.8627
843 GPJ 0.8625
844 IZC 0.8623
845 795 0.8623
846 VNJ 0.8622
847 1A5 0.8621
848 PFF 0.8620
849 GZ3 0.8618
850 JAH 0.8618
851 1WD 0.8614
852 1P3 0.8613
853 H62 0.8612
854 9BF 0.8609
855 FUB 0.8608
856 XX3 0.8604
857 DDU 0.8603
858 5GT 0.8602
859 LVD 0.8602
860 KIB 0.8601
861 GRO 0.8599
862 CTS 0.8599
863 YIE 0.8596
864 3ID 0.8594
865 AHC 0.8591
866 VD9 0.8591
867 ARG 0.8584
868 IP0 0.8584
869 SJ5 0.8584
870 T9G 0.8580
871 AX3 0.8579
872 AT3 0.8577
873 A5P 0.8576
874 51R 0.8576
875 1DJ 0.8574
876 ZZZ 0.8572
877 PAH 0.8572
878 PMF 0.8570
879 CK2 0.8569
880 IOM 0.8569
881 CRN 0.8568
882 1BN 0.8566
883 1WC 0.8566
884 MVN 0.8565
885 BEA 0.8565
886 MNN 0.8558
887 IT2 0.8555
888 MXN 0.8554
889 IFM 0.8554
890 DS0 0.8549
891 4BF 0.8549
892 G14 0.8546
893 EA1 0.8544
894 FDB 0.8542
895 2LY 0.8541
896 JZ4 0.8541
897 ICT 0.8529
898 2CL 0.8527
899 SQ7 0.8527
900 DC5 0.8526
901 MO8 0.8519
902 3VW 0.8517
903 2FG 0.8514
904 DTU 0.8511
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1SQA; Ligand: UI1; Similar sites found with APoc: 19
This union binding pocket(no: 1) in the query (biounit: 1sqa.bio1) has 34 residues
No: Leader PDB Ligand Sequence Similarity
1 2EC9 24X 46.5306
2 3VXE DPN PRO ARG 47.3469
3 2A2X NA9 47.3469
4 2A2X NA9 47.3469
5 2ANK N12 47.3469
6 1O0D 163 47.3469
7 1O0D 163 47.3469
8 2FES 3SP 47.3469
9 2FEQ 34P 47.3469
10 2FEQ 34P 47.3469
11 1NZQ 162 47.3469
12 2ANM CDO 47.3469
13 1C4V IH2 47.3469
14 1NFU RRP 48.1633
15 2VH6 GSV 48.1633
16 4BTI 7R9 48.1633
17 1SL3 170 48.5714
18 1ETS MID 48.9796
19 1BHX R56 49.6599
APoc FAQ
Feedback