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Q8N1Q1 | CAH13_HUMAN | Carbonic anhydrase 13 (CA13)

3D structures mapped by conservation among orthologs

[ Domain: "Carbonic anhydrase" // Carb_anhydrase ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL71611 OBDepict F H 2 N S Cl HN O O N S N S O O NH 2 Ki = 0.7 nM 387.83 Nc1c(F)cc(S(=O)(=O)Nc2nnc(S(N)(=O)=O)s2)cc1Cl Homo sapiens CHEMBL1211832 single protein format
CHEMBL220491 OBDepict CH 3 O N S O O H HN S CH 3 S O O NH 2 Ki = 11.0 nM 383.52 CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(S(N)(=O)=O)cc21 Homo sapiens CHEMBL2446190 single protein format
CHEMBL78755 OBDepict O HN N H S O O H 3 C S O O H 2 N Ki = 11.0 nM 369.42 Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL3101062 single protein format
CHEMBL4754146 OBDepict Cl Cl N O N S O O NH 2 Ki = 15.4 nM 370.22 NS(=O)(=O)c1cccc(-c2nnc(-c3ccc(Cl)cc3Cl)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL4788629 OBDepict _ O + N O N O N S O O NH 2 Ki = 16.2 nM 346.32 NS(=O)(=O)c1cccc(-c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL4460034 OBDepict Cl N O N S O O NH 2 Ki = 16.4 nM 335.77 NS(=O)(=O)c1cccc(-c2nnc(-c3ccc(Cl)cc3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL4799997 OBDepict F F N O N S O O NH 2 Ki = 17.0 nM 353.35 NS(=O)(=O)c1ccc(N2CCN(c3ccc(F)cc3F)C2=O)cc1 Homo sapiens CHEMBL4736957 assay format
CHEMBL20 OBDepict CH 3 N H O N S N S O O NH 2 Ki = 17.0 nM 222.25 CC(=O)Nc1nnc(S(N)(=O)=O)s1 Homo sapiens CHEMBL1048396 single protein format
CHEMBL4755773 OBDepict N N O N S O O H 2 N Ki = 17.0 nM 326.34 N#Cc1ccc(-c2nnc(-c3cccc(S(N)(=O)=O)c3)o2)cc1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL218490 OBDepict CH 3 N H H H CH 3 S S O O S O O NH 2 Ki = 18.0 nM 324.45 CCN[C@H]1C[C@H](C)S(=O)(=O)c2sc(S(N)(=O)=O)cc21 Homo sapiens CHEMBL2446190 single protein format
CHEMBL4791033 OBDepict H 2 N S O O N O N S Ki = 18.4 nM 307.36 NS(=O)(=O)c1cccc(-c2nnc(-c3cccs3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL19 OBDepict CH 3 N O S N H 3 C N S O O NH 2 Ki = 19.0 nM 236.28 CC(=O)/N=c1/sc(S(N)(=O)=O)nn1C Homo sapiens CHEMBL1799009 single protein format
CHEMBL4787403 OBDepict _ O + N O N O N S O O NH 2 Ki = 19.1 nM 346.32 NS(=O)(=O)c1cccc(-c2nnc(-c3cccc([N+](=O)[O-])c3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL352535 OBDepict _ O 3+ Cl _ O _ O _ O H 3 C + N CH 3 H 3 C S O O NH 2 Ki = 21.0 nM 404.87 Cc1cc(C)[n+](CCc2ccc(S(N)(=O)=O)cc2)c(C)c1.[O-][Cl+3]([O-])([O-])[O-] Homo sapiens CHEMBL1211832 single protein format
CHEMBL17 OBDepict Cl Cl S S O O NH 2 O O NH 2 Ki = 23.0 nM 305.16 NS(=O)(=O)c1cc(Cl)c(Cl)c(S(N)(=O)=O)c1 Homo sapiens CHEMBL1799009 single protein format
CHEMBL4762313 OBDepict H 2 N S O O N O N Ki = 30.9 nM 301.33 NS(=O)(=O)c1cccc(-c2nnc(-c3ccccc3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL4747504 OBDepict CH 3 O O N O H 3 C N S O O H 2 N Ki = 31.4 nM 361.38 COc1ccc(OC)c(-c2nnc(-c3cccc(S(N)(=O)=O)c3)o2)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL21 OBDepict NH 2 S O O NH 2 Ki = 32.0 nM 172.21 Nc1ccc(S(N)(=O)=O)cc1 Homo sapiens CHEMBL1048396 single protein format
CHEMBL4798581 OBDepict CH 3 O O CH 3 N O N S O O H 2 N Ki = 36.7 nM 361.38 COc1ccc(-c2nnc(-c3cccc(S(N)(=O)=O)c3)o2)c(OC)c1 Homo sapiens CHEMBL4714273 single protein format
CHEMBL3099282 OBDepict O HN N H S O O H 3 C N S O O H 2 N Ki = 38.0 nM 370.41 Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(S(N)(=O)=O)nc2)cc1 Homo sapiens CHEMBL3101062 single protein format
CHEMBL4743714 OBDepict H 3 C O O CH 3 O N O CH 3 N S O O H 2 N Ki = 38.5 nM 391.41 COc1cc(-c2nnc(-c3cccc(S(N)(=O)=O)c3)o2)cc(OC)c1OC Homo sapiens CHEMBL4714273 single protein format
CHEMBL220492 OBDepict NH 2 S O O O O O H O CH 3 H 3 C H O H O CH 3 CH 3 Ki = 47.0 nM 339.37 CC1(C)O[C@@H]2CO[C@@]3(COS(N)(=O)=O)OC(C)(C)O[C@H]3[C@@H]2O1 Homo sapiens CHEMBL1048396 single protein format
CHEMBL1956578 OBDepict OH N O CH 3 H 3 C Ki = 59.0 nM 139.15 Cc1cc(C)o/c(=N/O)c1 Homo sapiens CHEMBL1960509 single protein format
CHEMBL191045 OBDepict OH O HN N N N H N Cl S O O NH 2 Ki = 62.0 nM 372.79 NS(=O)(=O)c1ccc(CNc2nc(Cl)nc(NCC(=O)O)n2)cc1 Homo sapiens CHEMBL1815541 single protein format
CHEMBL186422 OBDepict O N H Ki = 65.0 nM 145.16 O=c1ccc2ccccc2[nH]1 Homo sapiens CHEMBL1960497 single protein format
CHEMBL4643051 OBDepict CH 3 H 3 C O O H H N H HO N N N N H S O O NH 2 Ki = 65.3 nM 508.65 CC1(C)O[C@H]2[C@H](O)CN(CCCCCCn3cc(CNc4ccc(S(N)(=O)=O)cc4)nn3)C[C@H]2O1 Homo sapiens CHEMBL4615769 single protein format
CHEMBL189526 OBDepict HO O N H N N N H N Cl S O O NH 2 Ki = 68.0 nM 386.82 NS(=O)(=O)c1ccc(CCNc2nc(Cl)nc(NCC(=O)O)n2)cc1 Homo sapiens CHEMBL1815541 single protein format
CHEMBL265674 OBDepict NH 2 N S N S O O NH 2 Ki = 79.0 nM 180.21 Nc1nnc(S(N)(=O)=O)s1 Homo sapiens CHEMBL1211832 single protein format
CHEMBL4464229 OBDepict O N H N O N H O Se S O O NH 2 Ki = 88.4 nM 563.54 NS(=O)(=O)c1ccc(C[Se]c2ccc(NC(=O)CN3C(=O)NC4(CCCCCC4)C3=O)cc2)cc1 Homo sapiens CHEMBL4353557 single protein format
CHEMBL1956579 OBDepict OH N O Ki = 94.0 nM 161.16 O/N=c1/ccc2ccccc2o1 Homo sapiens CHEMBL1960509 single protein format
CHEMBL118 OBDepict H 3 C N N F F F S O O NH 2 Ki = 98.0 nM 381.38 Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL1211832 single protein format
CHEMBL1209038 OBDepict O N H N S N S O O NH 2 Ki = 118.0 nM 342.45 NS(=O)(=O)c1nnc(NC(=O)C23CC4CC(CC(C4)C2)C3)s1 Homo sapiens CHEMBL1211832 single protein format
CHEMBL573127 OBDepict O N H S S O O NH 2 Ki = 125.0 nM 296.37 NS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)cc1 Homo sapiens CHEMBL1799009 single protein format
CHEMBL1209039 OBDepict O N H N S N S O O NH 2 Ki = 147.0 nM 356.47 NS(=O)(=O)c1nnc(NC(=O)CC23CC4CC(CC(C4)C2)C3)s1 Homo sapiens CHEMBL1211832 single protein format
CHEMBL3099281 OBDepict NH 2 N S O O NH 2 Ki = 155.0 nM 173.2 Nc1ccc(S(N)(=O)=O)nc1 Homo sapiens CHEMBL3101062 single protein format
CHEMBL902 OBDepict NH 2 N H 2 N S N S N H 2 N S O O NH 2 Ki = 171.5 nM 337.46 NC(N)=Nc1nc(CSCC/C(N)=N/S(N)(=O)=O)cs1 Homo sapiens CHEMBL4269594 single protein format
CHEMBL1822700 OBDepict CH 3 N CH 3 O N O N H 3 C H 3 C S O O NH 2 Ki = 236.0 nM 596.75 CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21c2ccccc2C(=O)N1c1cccc(S(N)(=O)=O)c1 Homo sapiens CHEMBL1826756 single protein format
CHEMBL1822699 OBDepict CH 3 N CH 3 O N O N H 3 C H 3 C S O O NH 2 Ki = 280.0 nM 596.75 CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21c2ccccc2C(=O)N1c1ccc(S(N)(=O)=O)cc1 Homo sapiens CHEMBL1826756 single protein format
CHEMBL865 OBDepict H 3 C O N S O O NH 2 Ki = 425.0 nM 314.37 Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 Homo sapiens CHEMBL2183719 single protein format
CHEMBL750 OBDepict OH S O NH N O Ki = 430.0 nM 212.23 N=S(=O)(O)Cc1noc2ccccc12 Homo sapiens CHEMBL1048396 single protein format
CHEMBL574246 OBDepict O N H S F S O O NH 2 Ki = 437.0 nM 314.36 NS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)c(F)c1 Homo sapiens CHEMBL1799009 single protein format
CHEMBL2443314 OBDepict F N N N H N F S O O NH 2 Ki = 470.0 nM 315.31 NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Homo sapiens CHEMBL2446520 assay format
CHEMBL2443317 OBDepict H 3 C O O N H N N N H N F S O O NH 2 Ki = 602.0 nM 384.39 COC(=O)CNc1nc(F)nc(NCCc2ccc(S(N)(=O)=O)cc2)n1 Homo sapiens CHEMBL2446520 assay format
CHEMBL2179306 OBDepict F F F S N N S O O NH 2 Ki = 714.0 nM 411.43 NS(=O)(=O)c1ccc(-n2ncc3c2-c2ccc(C(F)(F)F)cc2SC3)cc1 Homo sapiens CHEMBL2183719 single protein format
CHEMBL2443316 OBDepict CH 3 N H N N N H N F S O O NH 2 Ki = 735.0 nM 298.3 CNc1nc(F)nc(Nc2ccc(S(N)(=O)=O)cc2)n1 Homo sapiens CHEMBL2446520 assay format
CHEMBL4448793 OBDepict CH 3 N H O N O N H O Se S O O NH 2 Ki = 767.0 nM 563.54 CC1CCCC2(C1)NC(=O)N(CC(=O)Nc1ccc([Se]Cc3ccc(S(N)(=O)=O)cc3)cc1)C2=O Homo sapiens CHEMBL4353557 single protein format
CHEMBL4541654 OBDepict O N H N O N H O S O O NH 2 Ki = 808.5 nM 380.43 NS(=O)(=O)c1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 Homo sapiens CHEMBL4353557 single protein format
CHEMBL186716 OBDepict CH 3 N H N N N H N N H H 3 C S O O NH 2 Ki = 921.0 nM 309.36 CNc1nc(NC)nc(Nc2ccc(S(N)(=O)=O)cc2)n1 Homo sapiens CHEMBL2446520 assay format
CHEMBL2179308 OBDepict CH 3 O S N N S O O NH 2 Ki = 938.0 nM 373.46 COc1ccc2c(c1)SCc1cnn(-c3ccc(S(N)(=O)=O)cc3)c1-2 Homo sapiens CHEMBL2183719 single protein format