P00813 | ADA_HUMAN | Adenosine deaminase (ADA)
Pfam Domain Table
Accession | Domain | Range | Color |
---|---|---|---|
PF00962 | A_deaminase - Adenosine deaminase | 10~349 |
3D structures mapped by conservation among orthologs
[ Domain: "TIM barrels" // A_deaminase ]
[ Alpha Fold Model ] (go)
Known binders annotated in ChEMBL
molecule_chembl_id | structure | assay_type | relation | value | unit | mol_wt | smiles | organism | assay_chembl_id | bao_label |
---|---|---|---|---|---|---|---|---|---|---|
CHEMBL340297 | IC50 | = | 6.7 | nM | 481.0 | Cn1cc(CC[C@H](CO)n2cnc(C(N)=O)c2)c2cc(OCCCc3ccc(Cl)cc3)ccc21 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL359803 | IC50 | = | 8.6 | nM | 424.89 | C[C@H](O)[C@@H](CCc1cccc2nc(-c3ccc(Cl)cc3)oc12)n1cnc(C(N)=O)c1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL436332 | IC50 | = | 8.7 | nM | 424.89 | C[C@H](O)[C@@H](CCc1cccc2oc(-c3ccc(Cl)cc3)nc12)n1cnc(C(N)=O)c1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL328139 | IC50 | = | 15.0 | nM | 342.23 | C[C@H](O)[C@@H](CCc1cccc(Cl)c1Cl)n1cnc(C(N)=O)c1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL93560 | IC50 | = | 16.0 | nM | 323.4 | C[C@H](O)[C@@H](CCc1cccc2ccccc12)n1cnc(C(N)=O)c1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL327830 | IC50 | = | 570.0 | nM | 309.37 | NC(=O)c1cn(C(CO)CCc2cccc3ccccc23)cn1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL93647 | IC50 | = | 700.0 | nM | 369.48 | NC(N)=Nc1nc(-c2ccc(CNc3nc4ccccc4[nH]3)s2)cs1 | Homo sapiens | CHEMBL828409 | single protein format | |
CHEMBL1651378 | Ki | = | 0.0025 | nM | 266.26 | OC[C@H]1O[C@@H](n2cnc3c2N=CN=C[C@@H]3O)C[C@@H]1O | Homo sapiens | CHEMBL1655235 | single protein format | |
CHEMBL2112110 | Ki | = | 0.0025 | nM | 267.29 | OC[C@@H]1O[C@H](n2cnc3c2N=CCC[C@H]3O)C[C@H]1O | Homo sapiens | CHEMBL646136 | single protein format | |
CHEMBL1651377 | Ki | = | 0.01 | nM | 282.26 | OC[C@H]1O[C@@H](n2cnc3c2N=CN=C[C@@H]3O)[C@H](O)[C@@H]1O | Homo sapiens | CHEMBL1655235 | single protein format | |
CHEMBL604966 | Ki | = | 0.01 | nM | 283.28 | OC[C@@H]1OC(n2cnc3c2N=CCC[C@H]3O)[C@@H](O)[C@H]1O | Homo sapiens | CHEMBL646136 | single protein format | |
CHEMBL1651379 | Ki | = | 0.053 | nM | 291.4 | CCCCCCCC[C@@H](O)Cn1cc2c(N)ncnc2n1 | Homo sapiens | CHEMBL1655235 | single protein format | |
CHEMBL1580 | Ki | = | 0.1 | nM | 268.27 | OC[C@H]1O[C@@H](n2cnc3c2N=CNC[C@H]3O)C[C@@H]1O | Homo sapiens | CHEMBL873052 | single protein format | |
CHEMBL284483 | Ki | = | 0.1 | nM | 284.27 | OC[C@H]1O[C@@H](n2cnc3c2N=CNC[C@H]3O)[C@H](O)[C@@H]1O | Homo sapiens | CHEMBL873052 | single protein format | |
CHEMBL296435 | Ki | = | 2.0 | nM | 277.37 | CCCCCC[C@H]([C@H](C)O)n1cnc2c(N)ncnc21 | Homo sapiens | CHEMBL873052 | single protein format | |
CHEMBL340297 | Ki | = | 4.9 | nM | 481.0 | Cn1cc(CC[C@H](CO)n2cnc(C(N)=O)c2)c2cc(OCCCc3ccc(Cl)cc3)ccc21 | Homo sapiens | CHEMBL646140 | single protein format | |
CHEMBL18496 | Ki | = | 6.3 | nM | 276.38 | CCCCCCC(C(C)O)n1cnc2c(N)nccc21 | Homo sapiens | CHEMBL646138 | single protein format | |
CHEMBL125386 | Ki | = | 7.5 | nM | 446.51 | NC(=O)c1cn([C@@H](CO)CCn2ccc3ccc(NC(=O)NCc4ccccc4)cc32)cn1 | Homo sapiens | CHEMBL646140 | single protein format | |
CHEMBL93280 | Ki | = | 7.7 | nM | 499.58 | Cn1c(CCC(=O)Nc2ccc3ccn(CC[C@H](CO)n4cnc(C(N)=O)c4)c3c2)nc2ccccc21 | Homo sapiens | CHEMBL640462 | single protein format | |
CHEMBL92404 | Ki | = | 9.8 | nM | 339.39 | C[C@H](O)[C@@H](CCOc1ccc2ccccc2c1)n1cnc(C(N)=O)c1 | Homo sapiens | CHEMBL646137 | single protein format |