Receptor
PDB id Resolution Class Description Source Keywords
3C0G 2.19 Å EC: 2.7.11.1 CASK CAM-KINASE DOMAIN- 3'-AMP COMPLEX, P1 FORM HOMO SAPIENS CASK NEUREXIN CA2+/CALMODULIN DEPENDENT PROTEIN KINASE MGSYNAPTIC PLASTICITY PSEUDOKINASE MAGUK MEMBRANE-ASSOCIATGUANYLATE KINASE ATP-BINDING CALMODULIN-BINDING MAGNESIUBINDING NUCLEOTIDE-BINDING NUCLEUS SERINE/THREONINE-PROTKINASE SH3 DOMAIN TRANSFERASE
Ref.: CASK FUNCTIONS AS A MG2+-INDEPENDENT NEUREXIN KINAS CELL(CAMBRIDGE,MASS.) V. 133 328 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
3AM A:338;
B:338;
Valid;
Valid;
none;
none;
submit data
347.221 C10 H14 N5 O7 P c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3C0G 2.19 Å EC: 2.7.11.1 CASK CAM-KINASE DOMAIN- 3'-AMP COMPLEX, P1 FORM HOMO SAPIENS CASK NEUREXIN CA2+/CALMODULIN DEPENDENT PROTEIN KINASE MGSYNAPTIC PLASTICITY PSEUDOKINASE MAGUK MEMBRANE-ASSOCIATGUANYLATE KINASE ATP-BINDING CALMODULIN-BINDING MAGNESIUBINDING NUCLEOTIDE-BINDING NUCLEUS SERINE/THREONINE-PROTKINASE SH3 DOMAIN TRANSFERASE
Ref.: CASK FUNCTIONS AS A MG2+-INDEPENDENT NEUREXIN KINAS CELL(CAMBRIDGE,MASS.) V. 133 328 2008
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 107 families.
1 3MFU - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 3C0H - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 3C0I - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
4 3MFS - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
5 3C0G - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
6 3MFR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 82 families.
1 3MFU - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 3C0H - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 3C0I - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
4 3MFS - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
5 3C0G - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
6 3MFR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
50% Homology Family (492)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 55 families.
1 2E9O ic50 = 20 nM A58 C25 H27 N3 O2 CC1CCC(CC1....
2 2WMQ - ZYQ C9 H11 N3 O2 S CC(=O)Nc1n....
3 2BRO ic50 = 1.4 uM DF2 C21 H20 N4 O2 c1ccc(cc1)....
4 2QHN ic50 = 980 nM 582 C13 H13 N3 O CCN1c2cccc....
5 4RVM ic50 = 1 nM 3X7 C23 H21 N5 c1cc(ccc1C....
6 5DLS ic50 = 4.4 nM 5CV C31 H34 N6 O3 CC(C)(CN(C....
7 3TKI ic50 = 0.05 nM S25 C20 H23 N7 O2 S c1cnc(cc1N....
8 2YM5 ic50 = 0.43 uM YM5 C18 H21 N5 O2 c1cc(cc(c1....
9 4HYH ic50 = 1 nM 1AM C22 H22 N6 O3 S COc1ccc2c(....
10 1NVS Ki = 15 nM UCM C24 H15 N3 O3 c1ccc2c(c1....
11 2YDK ic50 = 0.007 uM YDK C17 H20 N4 O2 S c1ccc(cc1)....
12 3OT3 ic50 = 0.005 uM 22K C16 H20 Br N7 Cn1cc(cn1)....
13 2HXQ ic50 = 144 nM 373 C24 H26 N4 O c1ccc2c(c1....
14 2QHM ic50 = 660 nM 7CS C16 H19 N3 O2 CN1[C@H]2C....
15 2BRH ic50 = 22 uM DFW C20 H15 N3 O3 c1ccc(cc1)....
16 2R0U ic50 = 1 nM M54 C25 H22 N4 O2 c1cc(cc(c1....
17 1NVR Ki = 7.8 nM STU C28 H26 N4 O3 C[C@@]12[C....
18 3OT8 ic50 = 0.009 uM MI5 C19 H22 N8 S Cc1cc(sn1)....
19 2YM4 ic50 = 1.5 uM 4YM C21 H22 N6 O3 CCOC(=O)c1....
20 4HYI ic50 = 2 nM 1AO C21 H20 N6 O S c1ccc2c(c1....
21 4RVL ic50 = 41.7 nM 3XL C17 H10 N4 O c1ccc(c(c1....
22 2XF0 ic50 = 30 uM 4UB C15 H11 N5 c1ccc(cc1)....
23 2YM6 ic50 = 0.88 uM YM6 C14 H16 N6 O c1cncc2c1c....
24 4QYG ic50 = 0.0041 uM 3DW C22 H21 N5 O2 CN1CCN(CC1....
25 3TKH ic50 = 47 nM 07S C23 H27 N7 O2 S c1cc(cnc1)....
26 2XEZ ic50 = 1.5 uM XEZ C12 H9 N7 c1c[nH]nc1....
27 2HXL ic50 = 12 nM 422 C23 H24 N6 c1cc2c(cc1....
28 5F4N ic50 = 2.2 nM 5UY C17 H19 N7 O3 COC(=O)c1c....
29 2C3J Ki = 0.659 uM DBQ C11 H11 N5 O2 c1c[nH]c2c....
30 2YM7 ic50 = 0.13 uM YM7 C15 H18 N8 c1c(ncnc1N....
31 2X8I ic50 = 0.19 uM X8I C17 H13 N3 O2 CC1=CC2=NN....
32 2YDJ ic50 = 0.005 uM YDJ C17 H19 F N4 O2 S c1cc(cc(c1....
33 4QYE ic50 = 1.2 uM 3DL C17 H12 N2 O3 c1cc(cc(c1....
34 2BRG ic50 = 6.1 uM DFY C21 H19 N3 O2 CN(CCO)c1c....
35 2CGU ic50 = 13.4 uM 3A3 C17 H13 N O7 c1cc-2c(cc....
36 2WMR ic50 = 52 uM ZYR C10 H10 N2 O S C1CCc2c(c3....
37 3PA5 ic50 = 2 nM C73 C17 H19 Cl N4 O2 S c1cc(ccc1c....
38 2WMV ic50 = 9.2 uM ZYV C10 H14 N6 O c1[nH]c2c(....
39 2CGX ic50 = 15.6 uM 3D3 C7 H8 N6 O S c1nc(c2c(n....
40 4QYF - 3DV C17 H13 N3 O3 c1cc(cc(c1....
41 3JVS Ki = 0.146 uM AGY C22 H22 N4 O4 CC(C)(C)c1....
42 2WMW ic50 = 0.39 uM ZYW C11 H14 Br N5 O c1c2c(c(cn....
43 2BR1 Ki = 7.2 uM PFP C22 H21 N3 O4 COc1ccc(cc....
44 2C3L Ki = 0.026 uM IDZ C14 H10 N4 c1ccc2c(c1....
45 2X8E ic50 = 0.014 uM X8E C16 H12 N4 O CC1=CC2=NN....
46 2X8D ic50 = 0.8 uM X8D C11 H9 N3 O CC1=CC2=NN....
47 2YEX ic50 = 0.0001 uM YEX C15 H12 N4 O CC1=CC2=NN....
48 2BRM Ki = 1.3 uM DFZ C20 H18 N4 O c1ccc(cc1)....
49 1NVQ Ki = 5.6 nM UCN C28 H26 N4 O4 C[C@@]12[C....
50 3PA4 ic50 = 3 nM C72 C19 H19 Cl N4 O S c1cc(ccc1c....
51 1JSV - U55 C10 H11 N5 O2 S c1cc(ccc1N....
52 1OIQ ic50 = 2.9 uM HDU C14 H13 N5 O Cc1c(n2ccc....
53 2W17 ic50 = 0.002 uM I19 C24 H30 F N7 O Cc1ncc(n1C....
54 2VTP ic50 = 0.003 uM LZ9 C17 H11 F3 N4 O2 c1cc(c(c(c....
55 1JVP ic50 = 1.6 uM LIG C15 H11 N3 c1ccc-2c(c....
56 1FVT - 106 C14 H9 Br N4 O3 S c1cc(ccc1/....
57 4KD1 - 1QK C21 H29 N6 O2 CCc1cnn2c1....
58 3LE6 ic50 = 0.035 uM 2BZ C17 H10 Cl N5 O2 Cc1c-2nc(c....
59 2VTI ic50 = 0.66 uM LZ3 C14 H12 N4 O3 S c1ccc2c(c1....
60 3LFS Ki = 2.5 uM A07 C17 H16 Cl N3 O CCCC(=O)Nc....
61 1PXI - CK1 C8 H5 Cl2 N3 S c1cnc(nc1c....
62 4LYN - 1YG C20 H23 N3 O2 S2 C[C@@H](c1....
63 1YKR ic50 = 0.56 uM 628 C20 H14 Cl2 N4 O3 S c1cc(c(c(c....
64 1PXN Ki ~ 0.32 uM CK6 C15 H15 N5 O S Cc1c(sc(n1....
65 2R3J ic50 = 10 nM SCJ C18 H14 Br N5 c1ccc(cc1)....
66 3IG7 ic50 = 9 nM EFP C18 H22 N4 O3 CC(=O)NC1C....
67 2VTS ic50 = 0.03 uM LZC C16 H23 N7 CC(C)Nc1cc....
68 1P2A ic50 = 12 nM 5BN C17 H15 F N4 O c1cc([nH]c....
69 2BHE ic50 = 1 uM BRY C16 H9 Br N2 O2 c1ccc2c(c1....
70 3UNK ic50 = 15 uM 0BY C17 H13 Cl N4 O2 c1ccc(c(c1....
71 2VTQ ic50 = 0.14 uM LZA C16 H17 F2 N5 O2 c1cc(c(c(c....
72 2C68 ic50 = 1.8 uM CT6 C18 H15 Br N5 c1cc(cc(c1....
73 3TIZ - 3TI C17 H13 N O2 c1ccc2c(c1....
74 3PXY ic50 = 5.9 uM JWS C10 H11 N5 O2 COc1ccc(c(....
75 2R3M ic50 = 10 nM SCX C19 H17 F2 N7 CCc1cnn2c1....
76 5JQ5 Kd = 2341 nM I74 C22 H30 N6 O CC(C)c1cnn....
77 2C6O - 4SP C18 H22 N6 O3 S c1cc(ccc1N....
78 1V1K Ki = 35 uM 3FP C22 H23 F4 N5 O2 CN(C)C[C@H....
79 2VTJ ic50 = 1.9 uM LZ4 C10 H9 Cl N4 O2 S c1cc(ccc1N....
80 3EZV - EZV C25 H25 N7 CN1CCN(CC1....
81 3PXZ Kd = 37 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
82 1W0X - OLO C15 H18 N6 O Cn1cnc2c1n....
83 2XMY Ki = 0.11 nM CDK C18 H21 N5 O4 S2 CC1=C(SC(=....
84 2UZO ic50 = 18 uM C62 C14 H10 N2 O5 S2 c1cc(ccc1c....
85 1KE7 ic50 = 8.9 nM LS3 C20 H15 N3 O4 S c1cc2c(cc1....
86 1DM2 - HMD C11 H10 Br N5 O2 C1CNC(=O)C....
87 1DI8 ic50 = 1 uM DTQ C16 H15 N3 O3 COc1cc2c(c....
88 5JQ8 - I73 C22 H30 N6 O CC(C)c1cnn....
89 1GIJ - 2PU C19 H22 N6 O2 c1cc2c(c(c....
90 2R3P ic50 = 900 nM 3SC C19 H12 Cl2 N6 S c1cc(c(c(c....
91 1KE8 ic50 = 1000 nM LS4 C18 H14 N4 O3 S2 c1ccc2c(c1....
92 2C6I ic50 = 11 uM DT1 C18 H22 N6 O3 S c1cc(ccc1N....
93 1PXP Ki ~ 0.22 uM CK8 C17 H19 N5 S Cc1c(sc(n1....
94 2UZN ic50 = 0.03 uM C96 C15 H13 N3 O4 S2 [H]/N=C/1N....
95 2B55 ic50 = 96 nM D31 C24 H31 N5 O2 c1cc-2c(c(....
96 5K4J - 6QB C21 H18 Cl F N6 O2 Cn1c(ccn1)....
97 3PJ8 - 404 C19 H26 N6 O CC[C@H](CO....
98 3LFQ - A28 C17 H15 F2 N3 O CCCC(=O)Nc....
99 2W05 ic50 = 0.001 uM FRT C20 H26 N6 O3 S Cc1ncc(n1C....
100 2XNB Ki = 149 nM Y8L C19 H22 N6 O S CC1=C(SC(=....
101 1HCK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
102 5IEX - 6AF C17 H21 Br N4 O3 S C[C@H]([C@....
103 2R3H ic50 = 20000 nM SCE C13 H13 N5 Cc1cnc2n1c....
104 3LFN Ki = 3160 nM A27 C23 H21 N3 O2 CCCC(=O)Nc....
105 3PY1 Kd = 37 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
106 2A4L ic50 = 0.4 uM RRC C19 H26 N6 O CC[C@H](CO....
107 1Y8Y ic50 = 2 uM CT7 C13 H11 Cl N4 O2 S CS(=O)(=O)....
108 1OIR ic50 = 0.032 uM HDY C23 H26 N6 O2 Cc1c(n2ccc....
109 1PXJ - CK2 C9 H10 N4 S Cc1c(sc(n1....
110 2VTO ic50 = 0.14 uM LZ8 C17 H13 F N4 O2 c1ccc(cc1)....
111 2BTR ic50 = 95 nM U73 C13 H15 N3 O S CC(C)C1=CN....
112 2VTA ic50 = 185 uM LZ1 C7 H6 N2 c1ccc2c(c1....
113 3EZR - EZR C26 H27 N7 O CN1CCN(CC1....
114 3ULI ic50 = 0.07 uM 1N3 C21 H25 Br N6 O2 COc1ccc(cc....
115 2DS1 ic50 = 6.4 nM 1CD C22 H21 N5 O3 C[C@@H]1C[....
116 5FP5 - 1Y6 C7 H5 F O2 c1cc(ccc1C....
117 2VTH ic50 = 120 uM LZ2 C10 H9 N O3 S c1cc2c(ccc....
118 1KE5 ic50 = 560 nM LS1 C16 H15 N3 O3 S CNS(=O)(=O....
119 3FZ1 - B98 C13 H15 N3 O2 S COc1ccc2c(....
120 1WCC ic50 = 350 uM CIG C4 H4 Cl N3 c1c(nc(cn1....
121 1E1V Ki = 12 uM CMG C12 H17 N5 O c1[nH]c2c(....
122 2VV9 ic50 = 0.017 uM IM9 C23 H29 N7 O2 Cc1ncc(n1C....
123 5IEV - R0N C18 H23 F3 N4 O3 S C[C@H]([C@....
124 4D1X - ESJ C11 H8 N2 O3 S2 c1cc2c(cc1....
125 2BTS ic50 = 20 nM U32 C12 H15 N3 O2 S2 CC(C)c1cnc....
126 1URW ic50 < 0.003 uM I1P C21 H24 N8 O2 S CN(C)CCCNS....
127 5FP6 - MFZ C11 H7 Cl2 N O c1cc(c2c(c....
128 1CKP - PVB C20 H25 Cl N6 O3 CC(C)[C@H]....
129 1KE6 ic50 = 5.7 nM LS2 C17 H15 N5 O3 S2 CNS(=O)(=O....
130 2C6K ic50 = 0.73 uM DT2 C17 H21 N7 O2 S c1cc(ccc1N....
131 2R3Q - 5SC C19 H16 Br N5 O Cc1ccccc1c....
132 1OIT ic50 < 0.003 uM HDT C17 H14 N6 O2 S c1ccn2c(c1....
133 3NS9 ic50 = 0.003 uM NS9 C20 H27 N5 O3 CC(C)c1cnn....
134 1H01 ic50 = 22 uM FAL C21 H23 Cl2 N5 O2 CN(C)C[C@H....
135 2EXM - ZIP C10 H13 N5 CC(=CCNc1c....
136 4BGH ic50 = 4 nM 3I6 C13 H16 Br N5 O3 S C[C@H](CO)....
137 2R3F ic50 = 500 nM SC8 C18 H13 Cl2 N5 c1cc(c(c(c....
138 1GII - 1PU C17 H16 N4 O2 c1ccnc(c1)....
139 2R64 ic50 = 0.03 uM 740 C23 H27 N5 O3 S c1cc(ccc1C....
140 5A14 - LQ5 C24 H26 F3 N7 O2 CN1CCN(CC1....
141 2C6L ic50 = 0.27 uM DT4 C17 H22 N8 O2 S c1cc(ccc1N....
142 2W06 - FRV C18 H20 N6 O2 S Cc1ncc(n1C....
143 4EZ7 - STU C28 H26 N4 O3 C[C@@]12[C....
144 5D1J ic50 = 48 nM 56H C17 H24 N4 O2 S2 CC(C)(C)c1....
145 5IEY - 6AE C14 H19 N5 O3 S C[C@H]([C@....
146 2VTT ic50 = 0.044 uM LZD C16 H17 F2 N5 O2 c1cc(c(c(c....
147 2VU3 ic50 = 0.047 uM LZE C16 H17 Cl2 N5 O2 c1cc(c(c(c....
148 2B54 - D05 C20 H15 Cl3 N4 O3 CCc1c2c(n(....
149 1GZ8 - MBP C10 H13 N5 O2 CC(C)C(=O)....
150 3PY0 ic50 = 0.13 uM SU9 C13 H11 N3 O2 COc1ccc2c(....
151 2VTR ic50 = 1.5 uM LZB C10 H10 Cl N5 CC(C)Nc1cc....
152 1E1X Ki = 1.3 uM NW1 C11 H17 N5 O2 C1CCC(CC1)....
153 3UNJ ic50 = 11 uM 0BX C17 H14 N4 O2 c1ccc(cc1)....
154 2A0C - CK9 C19 H26 N6 O2 CC[C@H](CO....
155 3TIY - TIY C11 H8 O5 c1c2c(c(c(....
156 2R3I ic50 = 1000 nM SCF C18 H14 F N5 c1ccc(c(c1....
157 1VYZ ic50 = 290 nM N5B C13 H13 N3 O c1ccc(cc1)....
158 3WBL ic50 = 23 uM PDY C20 H26 N6 O CCOc1ccc(c....
159 4RJ3 ic50 = 93 nM 3QS C22 H28 N6 O COC1CCN(CC....
160 2VTN ic50 = 0.85 uM LZ7 C12 H11 F N4 O2 CC(=O)Nc1c....
161 1AQ1 - STU C28 H26 N4 O3 C[C@@]12[C....
162 2C6M ic50 = 0.35 uM DT5 C17 H20 N6 O3 S c1cc(ccc1N....
163 2R3L ic50 = 100 nM SCW C18 H14 Br N5 c1ccc(cc1)....
164 1H08 - BYP BWP n/a n/a
165 1B38 Kd = 0.254 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
166 2B52 ic50 = 8 nM D42 C21 H23 N7 O2 S Cc1c(sc(n1....
167 1PXL - CK4 C16 H13 F3 N4 S Cc1c(sc(n1....
168 3S2P ic50 = 0.068 uM PMU C17 H22 N4 O3 CC(C)c1cc(....
169 2R3O ic50 = 600 nM 2SC C19 H17 N5 O c1ccc(cc1)....
170 3IGG ic50 = 95 nM EFQ C16 H19 N3 O3 COc1ccc(cc....
171 1R78 ic50 = 3 nM FMD C20 H20 F N3 O4 C[C@H]([C@....
172 2FVD Ki = 0.003 uM LIA C18 H21 F2 N5 O4 S COc1ccc(c(....
173 2VTL ic50 = 97 uM LZ5 C10 H9 N3 O c1ccc(cc1)....
174 1KE9 ic50 = 660 nM LS5 C16 H15 N5 O3 S c1ccc2c(c1....
175 1PYE ic50 = 0.32 uM PM1 C21 H13 F2 N3 O2 c1ccc(cc1)....
176 4EZ3 - 0S0 C11 H10 N4 O4 S c1cc(ccc1/....
177 1H07 ic50 = 3 uM MFP C24 H27 Br N6 O2 Cc1ccc(c(c....
178 2B53 ic50 = 0.6 uM D23 C19 H19 F3 N4 CC(C)(C)Nc....
179 2DUV ic50 = 0.087 uM 371 C19 H17 N O7 S Cc1cc2c(c(....
180 4D1Z - WG8 C13 H10 N2 O3 S c1cc2ccc(n....
181 4ACM Ki = 210 nM 7YG C20 H23 N7 O3 S CN(C)CCNS(....
182 5LI9 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
183 3A8W - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
184 3MB6 ic50 = 100 nM 01I C16 H8 O6 c1cc2c(cc(....
185 5M4F - 7FC C16 H8 Cl2 O5 c1cc(ccc1C....
186 5CVH - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
187 3BQC ic50 ~ 2 uM EMO C15 H10 O5 Cc1cc2c(c(....
188 5CU2 - 54G C8 H8 O3 Cc1ccc(c(c....
189 5MO5 - 4IH C17 H21 Cl N2 O2 S CS(=O)(=O)....
190 5M4I - 7FC C16 H8 Cl2 O5 c1cc(ccc1C....
191 5MP8 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
192 5MOV - HC4 C9 H8 O3 c1cc(ccc1C....
193 5MOH - YTX C9 H10 O4 COc1cc(ccc....
194 5CSH Kd = 270 uM 54E C13 H12 Cl N c1ccc(cc1)....
195 3OWL ic50 = 0.67 uM 19E C16 H11 Cl N2 O Cc1cnc(c2c....
196 5H8G ic50 < 0.003 uM 5Y4 C23 H29 N9 O CC(=O)Nc1c....
197 5B0X ic50 = 0.02 uM HCK C18 H14 N2 O4 S COc1ccc(cc....
198 5MO8 Kd = 1.64 uM C98 C26 H26 Cl N3 O4 c1ccc(cc1)....
199 3AT4 Kd = 2.26 nM CCK C20 H20 N6 O2 CC(C)Nc1cc....
200 3OWJ Ki = 0.86 uM 1EL C17 H14 N2 O2 Cc1c2c(c(c....
201 5CU0 - 54R C18 H21 Cl N2 O CC(=O)NCCC....
202 5H8E ic50 < 0.003 uM 5Y3 C21 H25 N9 O CC(=O)Nc1c....
203 3WAR - NIO C6 H5 N O2 c1cc(cnc1)....
204 5MOE Kd = 500 uM OQC C11 H10 Cl N O c1cc(c(cc1....
205 4KWP Ki = 0.04 uM EXX C12 H10 Br4 N2 O3 c1nc2c(n1[....
206 5CSP Kd = 58 uM 54G C8 H8 O3 Cc1ccc(c(c....
207 5CTP - 54R C18 H21 Cl N2 O CC(=O)NCCC....
208 5MOW - BR9 C5 H6 Br N3 c1c(cnc(c1....
209 4UB7 Ki = 2.5 nM 3G5 C16 H8 Br2 O5 c1cc(ccc1C....
210 5MMF - JMB C16 H19 Cl N CCC[NH2+]C....
211 1PJK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
212 3NSZ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
213 3AXW - TID C9 H7 N3 O2 S c1cc(ccc1c....
214 5MO6 - KXZ C19 H21 Cl N2 O3 c1ccc(cc1)....
215 2PVR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
216 3C13 - EMO C15 H10 O5 Cc1cc2c(c(....
217 5CS6 Kd = 630 uM K82 C10 H14 Cl N O CCCOc1ccc(....
218 3PE2 Ki = 0.175 nM E1B C20 H12 N4 O2 C#Cc1cccc(....
219 5CT0 - 54P C16 H18 Cl N O c1ccc(cc1)....
220 5CU6 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
221 5M4C - 7EY C16 H14 N2 O2 S2 Cc1ccc(cc1....
222 5MO7 - YRA C16 H17 Cl N2 O c1ccc(cc1)....
223 3OWK ic50 = 1.5 uM 18E C16 H11 Cl N2 O Cc1cnc(c2c....
224 5MMR - H83 C17 H21 Cl N2 c1ccc(cc1)....
225 5MPJ - J2P C15 H17 Cl N CC[NH2+]Cc....
226 5CSV - GAB C7 H7 N O2 c1cc(cc(c1....
227 5MOT - HBD C7 H7 N O2 c1cc(ccc1C....
228 3R0T ic50 = 0.91 nM FU9 C22 H16 F3 N5 O2 c1cc(cc(c1....
229 3PE1 Ki = 0.38 nM 3NG C19 H12 Cl N3 O2 c1cc(cc(c1....
230 3JUH - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
231 5CLP - 42J C8 H9 Cl2 N c1cc(c(cc1....
232 3H30 Ki = 29.2 uM RFZ C12 H12 Cl2 N2 O4 c1c2c(cc(c....
233 2ZJW ic50 = 0.04 uM REF C14 H6 O8 c1c2c-3c(c....
234 4GRB ic50 = 17 nM 0XG C19 H18 N4 O4 S CN(C)C(=O)....
235 3MB7 ic50 = 200 nM 14I C16 H8 O6 c1cc2c(cc(....
236 5CVF - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
237 5CX9 - 551 C20 H23 Cl N2 O3 COC(=O)CC(....
238 3FHR - P4O C21 H16 N4 O c1ccc2c(c1....
239 3R1N - 05B C22 H21 N5 O3 c1cc2c(cc1....
240 3SHE - I85 C24 H22 F3 N5 O2 c1cc(cc(c1....
241 3BWJ ic50 = 2.6 uM ARX C28 H47 N15 O7 [H]/N=C(N)....
242 3AGL Ki = 16 nM A03 C37 H63 N17 O9 [H]/N=C(N)....
243 1RE8 Ki = 0.3 nM BD2 C27 H26 N2 O6 c1ccc(c(c1....
244 1REJ Ki = 5 nM B1L C20 H22 N2 O5 c1cc(ccc1C....
245 5IZJ - 6J9 C10 H13 N5 c1c[nH]c2c....
246 3AG9 Ki = 9 nM A02 C40 H70 N18 O9 [H]/N=C(N)....
247 5IZF Kd = 1.7 nM 6J9 AZ1 DAR ACA DAR NH2 n/a n/a
248 2VZ6 - FEF C20 H19 N3 O4 c1ccc2c(c1....
249 2Z7Q - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
250 2Z7R ic50 = 3 nM STU C28 H26 N4 O3 C[C@@]12[C....
251 4UZH ic50 = 9800 nM JVE C15 H13 F N4 O c1ccc(c(c1....
252 2C6E - HPM C28 H31 N7 O4 COc1cc2c(c....
253 3H0Y ic50 = 0.006 uM 48B C23 H17 Cl F N5 O2 c1ccc(c(c1....
254 4B0G ic50 = 0.015 uM VEK C19 H21 Br N8 O Cc1cc(no1)....
255 4JBP ic50 = 41 nM YPH C34 H36 N6 O4 c1ccc(cc1)....
256 3H10 - 97B C30 H25 Cl F2 N6 O CN1CCN(CC1....
257 1MQ4 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
258 5EW9 Ki < 0.01 nM 5VC C22 H21 Cl F N3 O3 S c1cc(nc(c1....
259 4CEG - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
260 3DJ6 - AK6 C25 H24 N4 O3 S COc1ccc(cc....
261 2WQE - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
262 3FDN ic50 = 0.033 uM MMH C21 H22 N6 O3 Cc1c(c([nH....
263 4J8M ic50 = 48 nM CJ5 C26 H25 F3 N8 O c1cc(cc(c1....
264 5DR9 - 5E2 C16 H9 Br Cl N O2 c1cc(cc(c1....
265 4DEA ic50 = 256 nM NHI C18 H14 N4 O4 c1cc(ccc1C....
266 5DN3 Kd = 3.77 uM 5DN C16 H9 Br F N O2 c1cc(cc(c1....
267 4DEE - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
268 3UOD Kd = 49 nM 0C3 C18 H13 F3 N4 O2 c1ccc(c(c1....
269 3EFW - AK8 C25 H21 F3 N6 O2 Cc1cc(ccc1....
270 5DT0 - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
271 3UO4 Kd = 299 nM 0C0 C23 H18 N4 O2 c1ccc(cc1)....
272 3UP2 Kd = 40 nM 0C8 C18 H13 F3 N4 O3 c1ccc(c(c1....
273 5DR2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
274 3DJ5 - AK5 C21 H20 Br N5 O3 S COc1ccc(cc....
275 3UOL ic50 = 3.1 nM 0C7 C17 H13 Cl N8 c1ccc(c(c1....
276 3D14 ic50 = 22 nM AK1 C19 H15 F3 N6 O S2 c1cc(cc(c1....
277 4BN1 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
278 2NP8 ic50 = 42 nM CC3 C21 H18 F3 N5 O c1cc(cc(c1....
279 4JBQ - VX6 C23 H28 N8 O S Cc1cc([nH]....
280 5DRD - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
281 5DPV - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
282 4UYN ic50 = 2 nM Y3M C25 H22 N4 O4 S CCOC(=O)c1....
283 5DT3 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
284 2WTV Ki = 1.8 nM ZZL C25 H15 Cl F2 N4 O2 c1cc(c(c(c....
285 3O50 - LJE C24 H17 F3 N4 O2 Cc1cc(ccc1....
286 2J4Z ic50 = 65 nM 626 C23 H24 N6 O2 S CN1CCN(CC1....
287 3LAU ic50 = 0.044 uM OFI C17 H17 N3 O2 CCCC(=O)Nc....
288 3DAJ ic50 = 2.9 uM FXG C22 H29 N7 O2 CCCCNC(=O)....
289 4JBO ic50 = 24 nM WPH C31 H32 N6 O3 CN(C)CCOc1....
290 2C6D - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
291 4KS7 - X4Z C25 H28 N8 O S Cc1nc2ccsc....
292 1M2P - HNA C14 H7 N O6 c1cc2c(c(c....
293 1LPU - BEN C7 H8 N2 [H]/N=C(c1....
294 2QC6 ic50 = 0.1 uM G12 C10 H6 Br2 O3 CC1=C(C(=O....
295 4ANM ic50 = 28 nM WUL C15 H14 Br N3 O3 c1cc2c(cc1....
296 1DAW - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
297 4RLK - E91 C21 H14 N2 O2 c1ccc2c(c1....
298 2OXD - K32 C7 H2 Br4 N2 O c12c(c(c(c....
299 2PVM Ki = 0.36 uM P29 C17 H15 N9 c1ccc(cc1)....
300 1J91 - TBS C6 H Br4 N3 c12c(c(c(c....
301 4DGO ic50 = 0.57 uM 0JW C10 H10 N2 O3 c1cc(c(cc1....
302 3FL5 - TXQ C14 H8 O6 c1cc(c(c2c....
303 3PWD ic50 = 0.22 uM CZ0 C14 H9 N O5 CC1=CC(=O)....
304 3KXH - K66 C11 H9 Br4 N3 O2 CN(C)c1nc2....
305 4DGM ic50 = 1.2 uM AGI C15 H10 O5 c1cc(ccc1C....
306 3PVG - K68 C9 H4 Br4 N2 O2 c1nc2c(n1C....
307 1ZOG Ki = 0.07 uM K37 C8 H4 Br4 N2 S CSc1[nH]c2....
308 2PVJ Ki = 0.005 uM P44 C19 H21 N7 c1ccc(cc1)....
309 4DGN ic50 = 0.35 uM LU2 C15 H10 O6 c1cc(c(cc1....
310 1M2Q - MNX C13 H7 N O6 c1cc(c2c(c....
311 2OXY - K17 C7 H2 Br4 N2 c1[nH]c2c(....
312 1M2R - MNY C14 H10 N2 O4 c1cc(c2c(c....
313 3KXN - K8X C7 H2 I4 N2 c1[nH]c2c(....
314 2PVL Ki = 0.024 uM P55 C18 H20 N8 CCN1CCN(CC....
315 1LP4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
316 2PVN Ki = 0.00035 uM P63 C20 H16 N8 O CC(=O)Nc1c....
317 3KXG - K6X C7 H Br5 N2 c12c(c(c(c....
318 3BE9 Ki = 24 nM P04 C19 H21 N7 O c1cc2cc(c1....
319 2OXX - K22 C7 H2 Br4 N2 S c12c(c(c(c....
320 3KXM - K74 C11 H9 Br4 N3 O S CNC(=O)CSc....
321 1LR4 - BEN C7 H8 N2 [H]/N=C(c1....
322 1OM1 Ki = 0.17 uM IQA C17 H12 N2 O3 c1ccc2c(c1....
323 1ZOH Ki = 0.1 uM K44 C10 H7 Br4 N3 C[N@@]1CCn....
324 2PVK Ki = 0.008 uM P45 C19 H14 Cl N7 c1ccc(cc1)....
325 1DAY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
326 1JKL - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
327 3F5G - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
328 5AUZ ic50 = 98 uM GEN C15 H10 O5 c1cc(ccc1C....
329 1P4F - DRG C12 H11 N3 c1ccc-2c(c....
330 4TXC Kd = 0.24 uM 38G C24 H27 N5 O3 CN(C)CCN[C....
331 2YAK ic50 = 2 nM OSV C27 H31 F N4 O3 Ru S4 CC(C)Oc1cc....
332 5AUY ic50 = 1.6 uM MRI C15 H10 O7 c1cc(c(cc1....
333 3EH9 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
334 1IG1 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
335 5AUW ic50 = 8.9 uM QUE C15 H10 O7 c1cc(c(cc1....
336 5AV2 - KMP C15 H10 O6 c1cc(ccc1C....
337 3EHA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
338 5AV3 - KMP C15 H10 O6 c1cc(ccc1C....
339 5AUT Kd = 6.7 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
340 5AV0 ic50 = 280 uM 47X C15 H10 O5 c1cc(c(cc1....
341 1JKK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
342 3F5U - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
343 5AV4 - GEN C15 H10 O5 c1cc(ccc1C....
344 5AUX ic50 = 10 uM KMP C15 H10 O6 c1cc(ccc1C....
345 5AUV ic50 = 31 uM AGI C15 H10 O5 c1cc(ccc1C....
346 2XK6 - EQH C18 H21 N3 O2 S c1csc(c1C2....
347 2WQO - VGK C21 H20 N2 O5 COc1cc(cc(....
348 2XKE ic50 = 4.2 uM WI2 C17 H20 N4 O3 COc1cccc(c....
349 2XNN - 430 C21 H16 F3 N3 O2 S C[C@H](c1c....
350 2XK7 ic50 = 1.5 uM 30E C21 H28 N4 O5 CC[C@H]1C[....
351 3QD4 ic50 = 0.00000001 M 3Q6 C22 H30 N8 O2 C[C@@H]1C[....
352 3RCJ ic50 = 0.8 uM 3RC C16 H13 N5 c1ccc(cc1)....
353 2PE0 - 39Z C14 H12 N2 O2 CC(c1ccc[n....
354 4CT2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
355 5ACK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
356 3HRC - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
357 5LVM - ADE C5 H5 N5 c1[nH]c2c(....
358 5MRD ic50 = 36.4 uM S26 C18 H13 Cl N2 O4 S2 CCOC(=O)C1....
359 3ION ic50 = 8 nM 8H1 C28 H27 N5 O3 COc1cc2c3c....
360 1UU7 ic50 = 14 uM BI2 C27 H26 N4 O2 C[N@@]1CCC....
361 3HRF Kd = 10.3 uM P47 C17 H15 Cl O2 c1ccc(cc1)....
362 3QCS ic50 = 0.00000001 M 3Q1 C15 H17 N7 O c1cc2c(cc1....
363 1H1W - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
364 4AW1 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
365 2PE2 - 464 C28 H30 N6 O3 c1cc(cc(c1....
366 3H9O ic50 = 70 nM 9BD C19 H19 N5 O3 COCCOc1cc2....
367 1Z5M ic50 = 30 nM LI8 C23 H31 Br N8 O3 CC(C)(C(=O....
368 5HKM ic50 = 0.013 uM 61Y C16 H15 N7 CCc1cc(nc(....
369 3QD0 ic50 = 0.00000001 M 3Q4 C24 H26 N8 O C[C@@H]1CC....
370 3ORZ - BI4 C27 H26 N4 O2 C[N@]1CCC[....
371 5LVN Kd = 20 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
372 2XCH ic50 = 374 nM CKG C22 H25 N7 O c1c2c(nc(n....
373 4AW0 - MJF C18 H15 Cl O5 c1ccc(cc1)....
374 3OTU - BI4 C27 H26 N4 O2 C[N@]1CCC[....
375 3QCX ic50 = 0.00000001 M 3Q2 C16 H19 N7 O C[C@@H]1CO....
376 1UU3 ic50 = 0.75 uM LY4 C28 H28 N4 O3 CN(C)C[C@@....
377 5LVL Kd = 1.25 uM 537 C14 H8 N2 O c1ccc2c(c1....
378 3QC4 ic50 = 0.002 uM MP7 C28 H22 F2 N4 O4 c1ccc(cc1)....
379 3QCY ic50 = 0.00000001 M 3Q3 C22 H22 N8 O2 c1ccc(cc1)....
380 1UU8 ic50 = 9 uM BI1 C25 H24 N4 O2 CN(C)CCCn1....
381 4CT1 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
382 4A07 - AZ7 C17 H13 Cl3 N2 O2 c1cc(ccc1[....
383 2JDO ic50 = 0.23 uM I5S C20 H22 Cl N3 O3 S c1cc2cnccc....
384 1O6K - GLY ARG PRO ARG THR THR SER PHE ALA GLU n/a n/a
385 3E88 Ki = 2 nM G96 C24 H27 N7 O3 CCn1c2cc(n....
386 3D0E ic50 = 13 nM G93 C21 H27 N7 O3 CCn1c2c(cn....
387 2X39 ic50 = 30 nM X39 C19 H21 Cl N6 O c1cc(ccc1C....
388 3E87 - GLY ARG PRO ARG THR THR SER PHE ALA GLU n/a n/a
389 4QMP ic50 = 0.014 uM DKI C15 H13 F2 N7 O2 S2 c1cc(c(c(c....
390 4U8Z - 3FE C17 H15 N5 O c1cc(cc(c1....
391 4QMX ic50 = 11 uM H8H C27 H32 Cl N5 O5 CN1CCN(CC1....
392 4QMT ic50 = 0.01 uM H1N C29 H32 N4 O3 S CCS(=O)(=O....
393 4QMW ic50 = 0.086 uM KS1 C17 H17 N7 c1c[nH]c2c....
394 3A7H - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
395 4QML - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
396 4QO9 ic50 = 0.16 uM 627 C26 H30 N6 O3 CN1CCN(CC1....
397 4QMQ ic50 = 0.26 uM 34U C24 H27 N5 O2 COCCOc1ccc....
398 4NUS ic50 = 0.005 uM 2NK C22 H21 F2 N3 O CN1CCN(CC1....
399 4NW6 ic50 = 0.004 uM 2NS C23 H20 N4 O4 COc1cc(cc(....
400 4NW5 ic50 = 0.02 uM 2NR C23 H21 F N2 O5 COc1cccc(c....
401 4EL9 - AFE C21 H20 O10 C[C@H]1[C@....
402 5D9L ic50 = 0.024 uM 583 C15 H12 N2 O2 c1cc(ccc1c....
403 4FII - ARG PRO LYS PRO LEU VAL ASP PRO n/a n/a
404 4JDK - ARG ARG ARG ARG SER TRP TYR n/a n/a
405 2W7X ic50 = 138 nM D1A C18 H17 N7 O3 [H]/N=C(N)....
406 4A9U - A9U C27 H28 N4 O2 c1ccc(cc1)....
407 2YCF ic50 = 0.7 nM YCF C19 H24 N10 O3 [H]/N=C(N/....
408 4BDI ic50 = 227.7 uM HAU C14 H19 N3 O2 Cc1ccc(nc1....
409 2YCR ic50 = 69.6 nM HCW C23 H28 N10 O C/C(=NNC1=....
410 2WTJ ic50 = 0.7 uM WTJ C16 H20 N4 O3 S CN(C)CCNC(....
411 2YIT ic50 = 0.29 nM YIT C21 H24 N6 O2 CCC/C(=NNC....
412 2W0J ic50 = 240 nM ZAT C19 H24 N10 O [H]/N=C(N)....
413 2XK9 ic50 = 0.03 nM XK9 C18 H17 N7 O4 C/C(=NNC(=....
414 2YCS ic50 = 1.36 nM NXP C18 H18 N6 O C/C(=NNC(=....
415 2WTI ic50 = 0.092 uM WTI C18 H15 N3 O3 S c1cc(ccc1c....
416 2YIR ic50 = 0.17 nM YIR C20 H19 N7 O3 [H]/N=C(N)....
417 2XBJ ic50 = 0.86 uM XBJ C23 H27 F N4 O4 CC(C)([C@@....
418 2XM9 ic50 = 0.009 uM LWH C21 H20 N6 O c1ccc2c(c1....
419 2YIQ ic50 = 12.67 nM YIQ C20 H19 N7 O C/C(=NNC(=....
420 2CN5 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
421 4FG9 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
422 4FG8 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
423 5L2T - 6ZZ C23 H30 N8 O CN(C)C(=O)....
424 5L2S - 6ZV C27 H32 F2 N8 CCN1CCN(CC....
425 4AUA ic50 = 7.2 uM 4AU C12 H9 N3 O c1ccc2c(c1....
426 2WEI ic50 = 3.4 nM VGG C17 H21 N5 Cc1cccc(c1....
427 3CQW ic50 = 42 nM CQW C12 H11 Cl N6 c1c(c2c([n....
428 4GV1 ic50 = 3 nM 0XZ C21 H25 Cl N6 O2 c1cc(ccc1[....
429 3MVH ic50 = 0.5 nM WFE C20 H22 F2 N6 O CCc1c[nH]c....
430 3MV5 ic50 = 180 nM XFE C11 H15 N5 Cc1c[nH]c2....
431 3QKL - SMR C29 H40 N4 O5 S CCOCC[N@@]....
432 3QKM ic50 = 0.038 uM SM9 C31 H43 N5 O4 S CCOCCN(C[C....
433 3CQU ic50 = 151 nM CQU C15 H13 N7 Cc1[nH]c(n....
434 3GC0 - AMP C10 H14 N5 O7 P c1nc(c2c(n....
435 3MFU - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
436 3C0H - AMP C10 H14 N5 O7 P c1nc(c2c(n....
437 3C0I - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
438 3MFS - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
439 3C0G - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
440 3MFR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
441 4OTH ic50 = 9 nM DRN C25 H23 N5 O2 S [H]/N=C(/N....
442 4OTI ic50 = 43 nM MI1 C16 H20 N6 O C[C@@H]1CC....
443 4APP Ki = 0.064 uM N53 C33 H36 N6 O3 CC1(c2c(c(....
444 4NJD ic50 = 0.79 uM NJD C21 H20 N8 O COc1nc(nc(....
445 2YAB - AMP C10 H14 N5 O7 P c1nc(c2c(n....
446 2YAA - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
447 3A62 - STU C28 H26 N4 O3 C[C@@]12[C....
448 3WF9 ic50 = 567 nM FS7 C24 H25 N3 O5 S C[C@H]1CCc....
449 3WF8 ic50 = 232 nM F76 C23 H23 N3 O5 S c1ccc2c(c1....
450 4L3L - 5FI C19 H21 F3 N6 CCc1cncnc1....
451 3WE4 ic50 = 15 nM 5FI C19 H21 F3 N6 CCc1cncnc1....
452 3WF7 ic50 = 206 nM FS9 C18 H17 F3 N6 O c1cc(cc(c1....
453 4L3J - 5FI C19 H21 F3 N6 CCc1cncnc1....
454 3WF6 ic50 = 33 nM FZ9 C18 H16 N6 c1ccc2c(c1....
455 4AU8 ic50 = 551 nM Z3R C11 H8 N2 O2 S3 c1ccc2c(c1....
456 4O0R Ki = 0.036 uM X4Z C25 H28 N8 O S Cc1nc2ccsc....
457 5IME Ki = 4.6 nM 6BZ C22 H22 Cl N7 O2 CC1=NC=CN(....
458 4ZY6 Ki = 5 nM 4T6 C18 H17 Cl N8 c1cc2c(c(c....
459 3Q53 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
460 4EQC ic50 = 0.008 uM XR1 C29 H28 Cl N7 O S CCN1c2c(cn....
461 5JZJ - AN2 C10 H16 N6 O9 P2 c1nc(c2c(n....
462 5AX9 ic50 = 8 nM 4KT C24 H24 N4 O3 COc1ccc(cc....
463 4EQU - G6I C30 H24 F3 N7 O2 Cc1ccc(cc1....
464 4JR7 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
465 4JQE - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
466 4MWH - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
467 4LFI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
468 3GGF - GVD C22 H19 N7 c1ccc2c(c1....
469 4OBQ ic50 = 0.065 uM 2QT C20 H20 F N5 O c1cc2c(cc1....
470 4U43 Kd = 48 uM 3D8 C11 H9 N5 c1cc(cnc1)....
471 3DAK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
472 1QL6 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
473 1PHK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
474 5F9E ic50 = 0.46 nM 5VS C23 H21 N5 O2 CC1(NC(=O)....
475 1XJD Ki = 0.33 nM STU C28 H26 N4 O3 C[C@@]12[C....
476 3M2W ic50 < 0.003 uM L8I C23 H21 F N4 O CN1CC2(C1)....
477 3BHY - 7CP C18 H18 Cl2 N4 O Cn1c2c(ccc....
478 2J90 - IZA C18 H16 F N3 O CC(C)(C)c1....
479 5DBX - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
480 2VN9 - GVD C22 H19 N7 c1ccc2c(c1....
481 4EJN ic50 = 0.005 uM 0R4 C33 H26 F N7 O2 CC(=O)Nc1c....
482 4WNO ic50 = 160 nM 3RF C20 H19 N7 c1ccc2c(c1....
483 4WNP ic50 = 8 nM 3RJ C22 H20 N8 c1ccc2c(c1....
484 5CI7 ic50 = 120 nM 51W C18 H24 I N7 O c1cc(cc(c1....
485 5M56 - 7FC C16 H8 Cl2 O5 c1cc(ccc1C....
486 5M4U - 7FC C16 H8 Cl2 O5 c1cc(ccc1C....
487 3OFM - 4B0 C9 H7 Br4 N3 O C(Cn1c2c(c....
488 2V7O - DRN C25 H23 N5 O2 S [H]/N=C(/N....
489 3TXO ic50 = 9 nM 07U C17 H19 N5 CC(C)(CNc1....
490 4USF - 6UI C19 H15 N3 O COc1ccc2cc....
491 1V0P ic50 = 0.13 uM PVB C20 H25 Cl N6 O3 CC(C)[C@H]....
492 1V0O ic50 = 5.5 uM INR C16 H10 N2 O5 S c1ccc2c(c1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 3AM; Similar ligands found: 358
No: Ligand ECFP6 Tc MDL keys Tc
1 3AM 1 1
2 A3P 0.794118 0.956522
3 PAP 0.72973 0.942857
4 PPS 0.701299 0.835443
5 2AM 0.691176 0.956522
6 XYA 0.640625 0.828571
7 ADN 0.640625 0.828571
8 RAB 0.640625 0.828571
9 A2P 0.626667 0.942029
10 AMP 0.625 0.956522
11 A 0.625 0.956522
12 OVE 0.616438 0.916667
13 7D5 0.605634 0.915493
14 APU 0.581633 0.905405
15 ATR 0.580247 0.928571
16 ABM 0.578947 0.902778
17 A2D 0.578947 0.902778
18 ADP 0.576923 0.929577
19 7D7 0.575758 0.8
20 5N5 0.573529 0.802817
21 SRA 0.573333 0.90411
22 A22 0.569767 0.916667
23 AN2 0.56962 0.916667
24 AMP MG 0.565789 0.876712
25 A4D 0.565217 0.802817
26 5CD 0.565217 0.788732
27 A12 0.564103 0.891892
28 AP2 0.564103 0.891892
29 BA3 0.564103 0.902778
30 SAP 0.560976 0.88
31 AGS 0.560976 0.88
32 AP5 0.556962 0.902778
33 B4P 0.556962 0.902778
34 BEF ADP 0.555556 0.842105
35 ADP BEF 0.555556 0.842105
36 ATP 0.555556 0.929577
37 7D3 0.551282 0.890411
38 SON 0.55 0.891892
39 APC 0.548781 0.891892
40 AQP 0.548781 0.929577
41 5FA 0.548781 0.929577
42 A A A 0.544444 0.864865
43 M33 0.54321 0.890411
44 CA0 0.54321 0.878378
45 AU1 0.54321 0.90411
46 ADX 0.54321 0.8125
47 ADP MG 0.54321 0.864865
48 EP4 0.541667 0.736842
49 A2R 0.54023 0.916667
50 A A 0.538462 0.929577
51 5AD 0.537313 0.753623
52 ACP 0.536585 0.90411
53 50T 0.536585 0.916667
54 M2T 0.534247 0.717949
55 DTA 0.534247 0.77027
56 101 0.532468 0.942857
57 AR6 0.53012 0.902778
58 APR 0.53012 0.902778
59 PRX 0.53012 0.878378
60 2A5 0.53012 0.90411
61 ACQ 0.529412 0.90411
62 TAT 0.529412 0.891892
63 ANP 0.529412 0.90411
64 Y3J 0.528571 0.732394
65 25A 0.52809 0.929577
66 MTA 0.527027 0.756757
67 A3G 0.525641 0.783784
68 7D4 0.52439 0.890411
69 RBY 0.52381 0.866667
70 AD9 0.52381 0.90411
71 ADV 0.52381 0.866667
72 ADQ 0.522222 0.90411
73 A U 0.519608 0.855263
74 ATF 0.517241 0.891892
75 ATP A A A 0.515789 0.888889
76 3DH 0.513158 0.756757
77 6RE 0.512821 0.766234
78 V3L 0.511628 0.929577
79 OOB 0.511111 0.890411
80 NA7 0.51087 0.891892
81 0WD 0.509434 0.857143
82 AOC 0.506329 0.805556
83 ADP PO3 0.505882 0.901408
84 5AL 0.505747 0.890411
85 00A 0.5 0.844156
86 MAP 0.5 0.88
87 DLL 0.5 0.890411
88 PUA 0.5 0.846154
89 5X8 0.5 0.746667
90 ZAS 0.5 0.75
91 3GP 0.5 0.90411
92 5AS 0.5 0.764706
93 ATP MG 0.5 0.864865
94 PAX 0.495575 0.814815
95 G A A A 0.495327 0.857143
96 25L 0.494737 0.916667
97 ADP BMA 0.494624 0.878378
98 5SV 0.494505 0.833333
99 SRP 0.494382 0.891892
100 ADP VO4 0.494382 0.890411
101 VO4 ADP 0.494382 0.890411
102 GAP 0.494253 0.878378
103 A3S 0.493976 0.794521
104 S4M 0.493827 0.670588
105 ETB 0.490909 0.797619
106 DCA 0.490909 0.788235
107 A5D 0.488372 0.77027
108 MAO 0.487805 0.743902
109 DSH 0.4875 0.730769
110 NEC 0.4875 0.753425
111 3OD 0.484211 0.878378
112 1ZZ 0.484211 0.802469
113 FYA 0.484211 0.890411
114 ALF ADP 0.483146 0.831169
115 ADP ALF 0.483146 0.831169
116 A3T 0.482353 0.805556
117 SFG 0.482353 0.733333
118 COA 0.482143 0.788235
119 0T1 0.482143 0.788235
120 J7C 0.481481 0.776316
121 A3N 0.481481 0.77027
122 103 0.481013 0.873239
123 QQY 0.481013 0.875
124 ACK 0.481013 0.926471
125 3AD 0.479452 0.84058
126 OAD 0.478723 0.878378
127 3UK 0.478723 0.878378
128 8QN 0.478261 0.890411
129 ANP MG 0.477778 0.855263
130 GJV 0.47561 0.75641
131 WAQ 0.473684 0.844156
132 4AD 0.473118 0.855263
133 PAJ 0.473118 0.846154
134 AMO 0.473118 0.866667
135 A1R 0.473118 0.868421
136 NVA 2AD 0.471264 0.75
137 SA8 0.471264 0.691358
138 30N 0.469565 0.72043
139 CAO 0.469565 0.761364
140 AMX 0.469565 0.797619
141 COS 0.469565 0.770115
142 FA5 0.469388 0.866667
143 DA 0.469136 0.888889
144 D5M 0.469136 0.888889
145 BIS 0.46875 0.868421
146 PTJ 0.46875 0.857143
147 QQX 0.468354 0.863014
148 AHX 0.468085 0.857143
149 DAL AMP 0.467391 0.864865
150 AV2 0.466667 0.876712
151 G5A 0.465909 0.764706
152 SAI 0.465909 0.717949
153 SAH 0.465909 0.727273
154 CMX 0.465517 0.788235
155 SCO 0.465517 0.788235
156 2VA 0.465116 0.783784
157 CC5 0.464789 0.8
158 ACO 0.461538 0.761364
159 FAM 0.461538 0.770115
160 FCX 0.461538 0.761364
161 3AT 0.460674 0.929577
162 3L1 0.459459 0.780822
163 3D1 0.459459 0.780822
164 9SN 0.459184 0.833333
165 A7D 0.458824 0.783784
166 LAD 0.458333 0.846154
167 PR8 0.458333 0.835443
168 HAX 0.457627 0.770115
169 EEM 0.455556 0.674699
170 YAP 0.454545 0.855263
171 FYN 0.453782 0.788235
172 3KK 0.453782 0.770115
173 TXA 0.453608 0.866667
174 NB8 0.453608 0.833333
175 ME8 0.453608 0.802469
176 MHZ 0.453488 0.702381
177 UPA 0.45283 0.868421
178 TSB 0.451613 0.761905
179 D3Y 0.451613 0.773333
180 A5A 0.450549 0.771084
181 U A G G 0.45045 0.844156
182 SOP 0.45 0.770115
183 CA6 0.45 0.697917
184 COK 0.45 0.770115
185 OXK 0.45 0.770115
186 MCD 0.45 0.770115
187 VRT 0.449438 0.753247
188 SO8 0.449438 0.773333
189 MYR AMP 0.44898 0.780488
190 DAT 0.448276 0.864865
191 PO4 PO4 A A A A PO4 0.447917 0.887324
192 CO6 0.446281 0.770115
193 1VU 0.446281 0.761364
194 CMC 0.446281 0.770115
195 NMX 0.446281 0.728261
196 S7M 0.445652 0.674699
197 SSA 0.445652 0.764706
198 SMM 0.445652 0.670588
199 V1N 0.445545 0.902778
200 4UV 0.445545 0.855263
201 ODP 0.445455 0.846154
202 SP1 0.444444 0.851351
203 SAM 0.444444 0.674699
204 RP1 0.444444 0.851351
205 3NZ 0.443299 0.766234
206 2MC 0.442623 0.736264
207 SCD 0.442623 0.788235
208 CAJ 0.442623 0.770115
209 APC G U 0.442478 0.844156
210 U A C C 0.442478 0.820513
211 LAQ 0.442308 0.802469
212 G3A 0.441176 0.857143
213 VMS 0.44086 0.752941
214 54H 0.44086 0.752941
215 52H 0.44086 0.744186
216 NPW 0.440367 0.825
217 1HE 0.439024 0.752809
218 IVC 0.439024 0.77907
219 BCO 0.439024 0.770115
220 3HC 0.439024 0.77907
221 MLC 0.439024 0.770115
222 A1S 0.439024 0.770115
223 JB6 0.438776 0.844156
224 G5P 0.436893 0.857143
225 AFH 0.436893 0.846154
226 AR6 AR6 0.436893 0.876712
227 4UU 0.436893 0.855263
228 GGZ 0.43617 0.7875
229 5CA 0.43617 0.764706
230 53H 0.43617 0.744186
231 XAH 0.435644 0.825
232 TYR AMP 0.435644 0.842105
233 MCA 0.435484 0.761364
234 YE1 0.435484 0.77907
235 CAA 0.435484 0.77907
236 COO 0.435484 0.770115
237 2BA 0.435294 0.9
238 CMP 0.435294 0.913043
239 A U C C 0.434426 0.833333
240 5J9 0.434343 0.759494
241 A6D 0.43299 0.707317
242 GTA 0.432692 0.825
243 NJP 0.432432 0.88
244 2CP 0.432 0.761364
245 MC4 0.432 0.728261
246 SCA 0.432 0.770115
247 GEK 0.431579 0.7
248 AMP DBH 0.431373 0.853333
249 OMR 0.429907 0.792683
250 COF 0.428571 0.752809
251 DTP 0.428571 0.864865
252 HGG 0.428571 0.770115
253 1GZ 0.428571 0.761364
254 AS 0.428571 0.842105
255 3CP 0.428571 0.770115
256 IRC 0.428571 0.77907
257 CA8 0.428571 0.697917
258 P5A 0.428571 0.730337
259 5F1 0.428571 0.716216
260 BYC 0.428571 0.770115
261 COW 0.428571 0.761364
262 2KQ 0.428571 0.752809
263 139 0.427273 0.835443
264 NDP 0.427273 0.857143
265 NSS 0.427083 0.744186
266 DSZ 0.427083 0.744186
267 0UM 0.427083 0.703704
268 LSS 0.427083 0.727273
269 FAQ 0.425197 0.770115
270 4CA 0.425197 0.761364
271 BCA 0.425197 0.761364
272 YLP 0.424528 0.804878
273 48N 0.424528 0.833333
274 AAT 0.423913 0.7125
275 NZQ 0.423423 0.846154
276 TXP 0.423423 0.857143
277 UCC 0.423077 0.752809
278 ANZ 0.423077 0.807692
279 DCC 0.423077 0.752809
280 MYA 0.423077 0.752809
281 ST9 0.423077 0.752809
282 MFK 0.423077 0.752809
283 5F9 0.423077 0.752809
284 NVA LMS 0.42268 0.727273
285 62X 0.42268 0.651163
286 GRA 0.421875 0.770115
287 HXC 0.421875 0.752809
288 A G U 0.420635 0.825
289 UP5 0.420561 0.855263
290 DND 0.420561 0.866667
291 NAX 0.420561 0.8125
292 NXX 0.420561 0.866667
293 4UW 0.420561 0.822785
294 TM1 0.42 0.759036
295 KB1 0.42 0.682927
296 0ET 0.419847 0.752809
297 TAD 0.419048 0.822785
298 TGC 0.418605 0.761364
299 K15 0.418367 0.666667
300 LEU LMS 0.418367 0.727273
301 TYM 0.416667 0.866667
302 S8M 0.416667 0.74359
303 U A A U 0.416667 0.868421
304 XNP 0.415929 0.835443
305 AFX 0.415584 0.706667
306 1DA 0.415584 0.828571
307 ARJ 0.415584 0.757143
308 S0N 0.415385 0.770115
309 CO8 0.415385 0.752809
310 1CZ 0.415385 0.761364
311 CCQ 0.415385 0.736264
312 2NE 0.415385 0.752809
313 CIC 0.415385 0.770115
314 T5A 0.414414 0.783133
315 GSU 0.414141 0.744186
316 KAA 0.414141 0.738636
317 NHW 0.413534 0.752809
318 UOQ 0.413534 0.752809
319 NHM 0.413534 0.752809
320 NOC 0.413333 0.746479
321 DDS 0.413043 0.837838
322 4TC 0.412844 0.833333
323 0FQ 0.412214 0.770115
324 4CO 0.412214 0.761364
325 LPA AMP 0.411215 0.780488
326 CNA 0.410714 0.866667
327 MRR 0.410448 0.752809
328 MRS 0.410448 0.752809
329 7MD 0.409524 0.825
330 01A 0.409091 0.736264
331 A4P 0.409091 0.807229
332 1DG 0.408333 0.857143
333 DG1 0.408333 0.857143
334 YSA 0.407767 0.744186
335 TXD 0.407407 0.844156
336 6V0 0.407407 0.833333
337 NAI 0.407407 0.844156
338 YNC 0.407407 0.761364
339 ZDA 0.406593 0.849315
340 CS8 0.406015 0.744444
341 1CV 0.406015 0.770115
342 WCA 0.406015 0.752809
343 IOT 0.405405 0.817073
344 8Z2 0.404412 0.744444
345 649 0.40367 0.711111
346 TXE 0.40367 0.844156
347 4KX 0.402985 0.744444
348 HDC 0.402985 0.752809
349 AHZ 0.401869 0.780488
350 ARG AMP 0.401869 0.814815
351 BT5 0.4 0.795181
352 7MC 0.4 0.804878
353 AP0 0.4 0.833333
354 YLB 0.4 0.804878
355 YLC 0.4 0.825
356 HFQ 0.4 0.752809
357 7C5 0.4 0.779221
358 NAP 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3C0G; Ligand: 3AM; Similar sites found: 287
This union binding pocket(no: 1) in the query (biounit: 3c0g.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2BOS GLA GAL 0.02606 0.40018 None
2 3I0O ADP 0.00009091 0.49955 1.17994
3 5COU ATP 0.005443 0.41616 1.47059
4 4OCJ NDG 0.001049 0.47929 1.7094
5 3TDV GDP 0.0002576 0.44558 1.96078
6 5I35 ANP 0.00001928 0.50331 1.9943
7 2QK4 ATP 0.0004427 0.44816 1.9943
8 1M0W ANP 0.001987 0.43417 1.9943
9 1IY8 NAD 0.02395 0.40538 1.9943
10 4JJF FE9 0.01749 0.40848 2.03488
11 4JJF N2I 0.01965 0.40848 2.03488
12 2WBV SIA 0.01483 0.42389 2.1164
13 5C4L 4XR 0.00005859 0.53306 2.18069
14 5C4L SIS 0.001436 0.46463 2.18069
15 1I7L ATP 0.0005059 0.47692 2.26537
16 4R78 AMP 0.001159 0.45316 2.26537
17 1ZB6 DIN 0.01721 0.40883 2.28013
18 1ZB6 GST 0.01826 0.40883 2.28013
19 5C1P ADP 0.000488 0.45963 2.28758
20 5C1P DAL DAL 0.00141 0.45726 2.28758
21 1IA9 ANP 0.0007238 0.42397 2.5
22 3UDZ ADP 0.00005065 0.51576 2.5641
23 1GY8 NAD 0.01469 0.41598 2.5641
24 4ZGP ADP 0.008396 0.40739 2.73038
25 4NBU NAI 0.02106 0.40818 2.8
26 3VPC ADP 0.00003843 0.4554 2.83688
27 3KAL ADP 0.003584 0.44766 2.849
28 1ZHX HC3 0.01192 0.4139 2.849
29 5HCF BGC 0.0114 0.41478 2.95203
30 4DFU QUE 0.004555 0.4296 3.10559
31 1T36 ADP 0.003176 0.44335 3.1339
32 4FHD 0TT 0.0143 0.41656 3.1339
33 4FHD EEM 0.0143 0.41656 3.1339
34 3ETH ATP 0.0005286 0.47212 3.4188
35 2YRX AMP 0.003591 0.43716 3.4188
36 4ZS4 ATP 0.0005847 0.42675 3.58306
37 1IOW ADP 0.001793 0.4639 3.59477
38 1IOW PHY 0.001793 0.4639 3.59477
39 3PDT ADP 0.001697 0.43733 3.63636
40 2PUL ACP 0.0004033 0.50142 3.7037
41 2IO8 ADP 0.0004796 0.40103 3.7037
42 2W9S NDP 0.01987 0.40444 3.72671
43 1W2D ADP 0.001368 0.44425 3.77358
44 2GQR ADP 0.007542 0.40956 3.79747
45 2PYW ADP 0.000001115 0.59654 3.9886
46 3ORQ ADP 0.001768 0.44525 3.9886
47 4WAS COO 0.01763 0.41751 3.9886
48 4XYM A12 0.0006557 0.46348 4.09483
49 5GZ9 ANP 0.0000004181 0.62228 4.2623
50 4U98 ACP 0.0008474 0.43411 4.2735
51 5TDF ADP 0.00712 0.4166 4.32099
52 4OCV ANP 0.0003205 0.44113 4.5584
53 1OX5 1PR 0.006953 0.42817 4.5584
54 1YP4 ADP 0.003822 0.42543 4.5584
55 5MRH Q9Z 0.002379 0.4381 4.8433
56 2X6T NAP 0.01073 0.42152 4.8433
57 4OR7 NAP 0.01705 0.40903 4.84848
58 3HAV ATP 0.00007108 0.46383 5.01672
59 5W2I I3P 0.001437 0.45515 5.05837
60 5W2I ADP 0.001437 0.45515 5.05837
61 2Q2V NAD 0.03249 0.40094 5.09804
62 5EPO NAP 0.02239 0.40566 5.12821
63 4LY9 S6P 0.04944 0.40305 5.12821
64 2CFM AMP 0.01131 0.40106 5.12821
65 4AZW ATP 0.002303 0.43981 5.41311
66 4AZT LY2 0.002788 0.42971 5.41311
67 4FFG LBS 0.008086 0.41054 5.41311
68 1TZD ADP 0.0005876 0.48142 5.45455
69 5IQD GNP 0.00001071 0.57783 5.57377
70 5IQD RIO 0.00001149 0.57783 5.57377
71 5MW8 ATP 0.00004254 0.52638 5.69801
72 5VZ0 ADP 0.0003296 0.47275 5.69801
73 4EIL NDP 0.01867 0.40708 5.69801
74 3OCP CMP 0.005468 0.40574 5.7554
75 4Q5H ANP 0.00005441 0.51175 5.76923
76 1OBD ATP 0.006012 0.40964 5.88235
77 2IF8 ADP 0.0005706 0.43509 6.33609
78 1DR1 HBI 0.03991 0.40038 6.34921
79 1DR1 NAP 0.03991 0.40038 6.34921
80 3K5I ADP 0.0008796 0.45959 6.55271
81 3K5I AIR 0.006838 0.43248 6.55271
82 1EHI ADP 0.001005 0.41826 6.55271
83 3ZJX BOG 0.01406 0.40661 6.57439
84 3TII ANP 0.003237 0.41716 6.83761
85 2YW2 ATP 0.0006856 0.41706 6.83761
86 4GYI ADP 0.0005426 0.45752 7.12251
87 4UWH JXM 0.008125 0.4059 7.12251
88 3X01 AMP 0.001261 0.45971 7.40741
89 1OGX EQU 0.006371 0.40216 7.63359
90 5C8W PCG 0.003973 0.40536 7.69231
91 4CYI ATP 0.0000001615 0.6362 7.97721
92 2Q7D ANP 0.001387 0.45928 7.97721
93 5ML3 DL3 0.02522 0.40961 8.05369
94 2FXD DR7 0.02598 0.40124 8.08081
95 5DZT AMP 0.0008958 0.42188 8.26211
96 3DNT ATP 0.007096 0.42179 8.26211
97 4R38 RBF 0.01367 0.40314 8.57143
98 5IXG OTP 0.03419 0.40993 8.87574
99 5A5W GUO 0.0112 0.43051 9.09091
100 2BKK ADP 0.004487 0.41548 9.09091
101 1ZMD FAD 0.04743 0.40168 9.11681
102 4WW7 AMP 0.0000002199 0.6328 9.1954
103 1TQP ATP 0.0001362 0.42458 9.21986
104 3V4S ATP 0.0009592 0.45981 9.56072
105 3V4S ADP 0.008637 0.43099 9.56072
106 5CKW ANP 0.00002243 0.51247 9.68661
107 1ZTH ADP 0.000008514 0.53048 9.68992
108 1ZP9 ATP 0.00001674 0.51425 9.68992
109 5UI2 EQ3 0.03273 0.40077 9.77918
110 5FI4 5XV 0.009854 0.41491 9.97151
111 4IX4 ADP 0.00002123 0.53605 10.2857
112 4QED NAP 0.02504 0.40325 11.2903
113 3VOT ADP 0.0003911 0.45885 11.396
114 3WVR AMP 0.000804 0.44242 11.396
115 2VPQ ANP 0.0003631 0.48189 11.9658
116 1UPR 4IP 0.02845 0.40411 12.1951
117 4J1Q NDP 0.02254 0.40305 12.5356
118 3MTX PGT 0.03575 0.40089 12.5828
119 3VHE 42Q 0.0000001038 0.47706 14.245
120 3UIM ANP 0.0000001023 0.58093 14.4172
121 4XH0 ADP 0.000002528 0.59622 14.5299
122 4B1L FRU 0.01411 0.40128 14.5455
123 2VQD AP2 0.0003644 0.43072 15.0997
124 2V58 LZJ 0.00178 0.47428 15.8129
125 3VPB ADP 0.00001696 0.54987 16.0714
126 4MV1 ADP 0.002287 0.45603 16.2393
127 4O1P ANP 0.00000006605 0.64798 16.5242
128 2QLU ADE 0.000003776 0.46097 16.5605
129 4O4F ATP 0.002686 0.44375 17.7419
130 4O4F IHP 0.002993 0.44308 17.7419
131 5C03 AGS 0.00000008467 0.64294 19.2982
132 5KO1 6UY 0.0000003385 0.57376 20.1413
133 5K2M ADP 0.001432 0.45521 22.6415
134 4WOV 3SM 0.0000125 0.5325 22.7129
135 4BKJ STI 0.0001303 0.50716 23.4921
136 4CLI 5P8 0.0000003609 0.66159 23.5474
137 4P5Z Q7M 0.000001331 0.62488 24.2165
138 3C1X CKK 0.00004312 0.4485 24.7863
139 4OAV ACP 0.0000002756 0.57858 25.0712
140 5LPZ ADP 0.0000001199 0.63587 25.3012
141 4E93 GUI 0.0000003163 0.45447 25.3561
142 4FL3 ANP 0.0000000682 0.65696 25.641
143 4Y85 499 0.0005827 0.46126 26.2048
144 3H9R TAK 0.000006473 0.56178 26.7806
145 4KBA 1QM 0.00000898 0.43959 26.8882
146 3GNI ATP 0.00000005863 0.657 27.0655
147 2PVF ACP 0.00000002208 0.62125 27.2455
148 4CRL C1I 0.0000008886 0.62655 27.3399
149 1JPA ANP 0.00000007951 0.46061 27.5641
150 4ASE AV9 0.0000004733 0.47053 27.9202
151 4Y93 746 0.00000357 0.46277 27.9202
152 1Y57 MPZ 0.0000008576 0.50217 28.2051
153 5EOB 5QQ 0.000008688 0.60218 28.2132
154 5LPB ADP 0.0000001554 0.60733 28.3784
155 3LXK MI1 0.0000002641 0.64192 28.4404
156 2H8H H8H 0.0000005597 0.54929 28.49
157 4YZC STU 0.0000000682 0.68786 28.7749
158 3RI1 3RH 0.00000045 0.62832 29.0735
159 3VRY B43 0.000001065 0.4803 29.3447
160 2Y6O 1N1 0.0000006457 0.61057 29.5533
161 5UR1 YY9 0.000001425 0.6297 29.582
162 5HX8 66P 0.00000001745 0.52452 29.8013
163 4YLL 4E3 0.000001149 0.60131 29.9145
164 4AT3 LTI 0.000001043 0.45341 30.1003
165 3PLS ANP 0.0000001044 0.6352 30.2013
166 3PP0 03Q 0.000003517 0.46067 30.4734
167 3KMW ATP 0.0001272 0.49195 30.6273
168 5HCY 60D 0.000001435 0.63102 30.8157
169 3KRR DQX 0.00000003737 0.73575 30.8475
170 5HES 032 0.0000004779 0.61678 30.9446
171 2CSN CKI 0.001335 0.49075 30.9764
172 4AG8 AXI 0.00000009018 0.44384 31.0127
173 5NKB 8ZT 0.0000002931 0.4155 31.6993
174 5FBN 5WF 0.00000476 0.59214 31.7343
175 4BTK DTQ 0.000003489 0.56748 31.7507
176 2OFV 242 0.000002153 0.61104 31.769
177 5JFS 6K0 0.000000191 0.67076 31.8182
178 4K33 ACP 0.00000007214 0.64954 32
179 5T8O 76Z 0.000001053 0.52054 32.0917
180 5USZ SKE 0.00000003383 0.68534 32.1799
181 5UKL SIX 0.00000936 0.56652 32.1937
182 3PVW QRX 0.00000001996 0.52698 32.1937
183 1OPK P16 0.000002497 0.42857 32.1937
184 3PTG 932 0.0000004754 0.57376 32.7635
185 3TTI KBI 0.000001167 0.46595 32.7635
186 3NW7 LGV 0.00000223 0.62406 32.899
187 3G5D 1N1 0.00000004259 0.72389 33.2168
188 1VJY 460 0.00000005652 0.68377 33.3333
189 4IDT T28 0.000003904 0.56219 33.3333
190 3SRV S19 0.00000001319 0.67691 33.574
191 4L9I 8PR 0.000001504 0.58143 33.6182
192 5U6C 7YS 0.000003044 0.57856 33.6508
193 1K3A ACP 0.0000003639 0.60282 33.7793
194 4U0I 0LI 0.000002429 0.60114 33.9683
195 4F4P 0SB 0.000002152 0.63831 34.0659
196 2X2M X2M 0.00000008647 0.65206 34.3949
197 5MJA 7O3 0.000005774 0.55117 34.4262
198 4EWH T77 0.00000002641 0.51121 34.5455
199 3GQI ACP 0.0000002779 0.56444 34.6626
200 3SXS PP2 0.000000861 0.60184 34.7015
201 2XVD AS6 0.000001668 0.46174 34.7682
202 3KRL KRL 0.00000009174 0.53955 35.2239
203 1BYG STU 0.00000001445 0.64698 35.2518
204 1U5R ATP 0.00000001421 0.61357 35.3276
205 5CEO 50D 0.000008401 0.54966 35.6667
206 4E1Z 0MX 0.00000003663 0.54638 35.7388
207 3LXN MI1 0.00000001094 0.58996 35.8491
208 1U59 STU 0.00000001234 0.61467 35.8885
209 5TA6 79D 0.0000005835 0.47691 35.8974
210 5H2U 1N1 0.00004622 0.47569 36.3296
211 2JLD AG1 0.0000001089 0.67177 36.4672
212 3ZRM ZRM 0.0000004643 0.60841 36.4672
213 4NM5 ADP 0.002686 0.46981 36.4672
214 5TO8 7FM 0.000002709 0.61097 36.5248
215 3F7Z 34O 0.00000009867 0.63983 36.5714
216 5DA3 58V 0.000002136 0.57604 36.6038
217 4YMJ 4EJ 0.00000001041 0.71818 36.8421
218 3GC8 B45 0.00003139 0.45577 37.037
219 4UX9 ANP 0.0000002364 0.54432 37.0879
220 4IZY 1J2 0.0000003364 0.5345 37.1274
221 3EKK GS2 0.000000173 0.43536 37.1335
222 3BU5 ATP 0.00000001276 0.68134 37.2549
223 4WNK 453 0.0000004449 0.63533 37.6068
224 4H3P ANP 0.0000000521 0.59263 37.6068
225 3FC2 IBI 0.001575 0.49303 37.6119
226 5BYZ 4WE 0.000005499 0.58366 37.6437
227 4BHN BH9 0.0000003486 0.53407 37.7246
228 5JGA 6KC 0.00000005474 0.47384 37.7778
229 5X8I SQZ 0.000000007833 0.6236 37.8613
230 5BVE 4VG 0.0000001787 0.69748 37.8917
231 2WU6 DKI 0.0000000215 0.68385 38.1766
232 1OUK 084 0.00003484 0.60106 38.1766
233 4LOO SB4 0.00004889 0.51392 38.1766
234 5MY8 RXZ 0.0000002331 0.63968 38.4615
235 5EKO N17 0.000105 0.50764 38.4615
236 2HK5 1BM 0.000000994 0.5989 38.5185
237 2OO8 RAJ 0.0005368 0.41383 39.1167
238 3HMO STU 0.00000007836 0.64099 39.1813
239 4QTB 38Z 0.0000002779 0.64314 39.3162
240 4H3Q ANP 0.0000005651 0.61603 39.6011
241 4GJ3 0XP 0.000000001537 0.52019 39.7351
242 2B9H ADP 0.0000001743 0.63154 39.886
243 2B9F ADP 0.000000187 0.62686 39.886
244 2B9J ADP 0.0000001904 0.62309 39.886
245 3E7O 35F 0.000006109 0.58324 39.886
246 2B9I ADP 0.0000001769 0.57117 39.886
247 3ALN ANP 0.000003007 0.57617 40.0612
248 4NST ADP 0.0000000074 0.69239 40.1709
249 5AWM ANP 0.000003198 0.56781 40.1709
250 5EFQ ADP 0.000000005391 0.69882 40.3458
251 5LI1 ANP 0.00000001485 0.68843 40.4558
252 4DC2 ADE 0.000000002021 0.60472 40.4558
253 1ZY5 ANP 0.0000001572 0.62695 40.5941
254 4XLI