HOME LIGAND hPROTEOME OTHERS DOCUMENT

P08311 | CATG_HUMAN | Cathepsin G (CTSG)

3D structures mapped by conservation among orthologs

[ Domain: "FMN-binding split barrel 2" // Trypsin_1 ]

download pymol session



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL47394 OBDepict O N N O IC50 = 0.39 nM 266.3 O=C1N(Cc2ccccc2)C(=O)N1Cc1ccccc1 Homo sapiens CHEMBL661876 single protein format
CHEMBL1807526 OBDepict OH O N O N S CH 3 IC50 = 2.1 nM 366.44 Cc1cccc2scc(Cn3c(=O)n(CCC(=O)O)c4ccccc43)c12 Homo sapiens CHEMBL1811508 single protein format
CHEMBL296771 OBDepict O N N O CH 3 H 3 C IC50 = 2.3 nM 266.3 Cc1ccc(N2C(=O)N(c3ccc(C)cc3)C2=O)cc1 Homo sapiens CHEMBL661876 single protein format
CHEMBL1807531 OBDepict OH O N O N N H 3 C CH 3 IC50 = 4.8 nM 363.42 Cc1cccc2c1c(Cn1c(=O)n(CCC(=O)O)c3ccccc31)cn2C Homo sapiens CHEMBL1811508 single protein format
CHEMBL335675 OBDepict CH 3 HN H 3 C H 3 C O O O H 3 C H 3 C N H O CH 3 O IC50 = 6.4 nM 536.71 CCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL1807638 OBDepict HO O N O N N CH 3 CH 3 H 3 C H 3 C IC50 = 7.0 nM 391.47 Cc1cc(Cn2c(=O)n(CCC(=O)O)c3ccccc32)c2c(c1)c(C)c(C)n2C Homo sapiens CHEMBL1811508 single protein format
CHEMBL108294 OBDepict H 3 C N H CH 3 CH 3 NH O H O O CH 3 O N IC50 = 8.4 nM 505.66 CCCCCCC(NC(=O)c1ccc(C#N)cc1)C(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCC Homo sapiens CHEMBL661877 single protein format
CHEMBL1807538 OBDepict OH O N O N N CH 3 H 3 C IC50 = 8.8 nM 363.42 Cc1cn(C)c2c(Cn3c(=O)n(CCC(=O)O)c4ccccc43)cccc12 Homo sapiens CHEMBL1811508 single protein format
CHEMBL1807535 OBDepict HO O N O N N S CH 3 H 3 C IC50 = 9.5 nM 381.46 Cc1cc(C)c2c(Cn3c(=O)n(CCC(=O)O)c4ccccc43)nsc2c1 Homo sapiens CHEMBL1811508 single protein format
CHEMBL270515 OBDepict OH B HO NH H O H 3 C H 3 C NH H HO CH 3 H O N IC50 = 13.7 nM 413.28 CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)[C@@H](C)O)B(O)O Homo sapiens CHEMBL1274448 single protein format
CHEMBL436591 OBDepict H 3 C HN O CH 3 CH 3 O O O H 3 C CH 3 HN O CH 3 IC50 = 21.0 nM 564.77 CCCC(=O)NC(CCc1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)CCC Homo sapiens CHEMBL661887 single protein format
CHEMBL1807640 OBDepict OH O N O N N Cl CH 3 H 3 C H 3 C IC50 = 22.0 nM 411.89 Cc1c(C)n(C)c2c(Cn3c(=O)n(CCC(=O)O)c4ccccc43)cc(Cl)cc12 Homo sapiens CHEMBL1811508 single protein format
CHEMBL424453 OBDepict H 3 C N H H 3 C H 3 C O O O CH 3 H 3 C NH O CH 3 O IC50 = 48.0 nM 564.77 CCCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL1807642 OBDepict HO O S N N S CH 3 IC50 = 52.0 nM 396.54 Cc1cccc2scc(Cn3c(SCCCC(=O)O)nc4ccccc43)c12 Homo sapiens CHEMBL2383100 single protein format
CHEMBL131704 OBDepict CH 3 HN CH 3 H 3 C O O O CH 3 CH 3 HN O CH 3 O IC50 = 75.0 nM 508.66 CCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL111705 OBDepict CH 3 N H H 3 C H 3 C HN O H O O H 3 C CH 3 O N IC50 = 77.0 nM 519.69 CCCCCCC(NC(=O)c1ccc(C#N)cc1)C(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC(C)C Homo sapiens CHEMBL661877 single protein format
CHEMBL135080 OBDepict CH 3 HN H 3 C H 3 C O O O H 3 C H 3 C N H O CH 3 O IC50 = 80.0 nM 592.82 CCCCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL515494 OBDepict OH O F F F N NH H O NH 2 S F IC50 = 90.0 nM 443.42 N#C[C@@]1(NC(=O)C(N)Cc2sccc2F)C[C@@H]1c1ccccc1.O=C(O)C(F)(F)F Homo sapiens CHEMBL1007397 cell-based format
CHEMBL516292 OBDepict OH O F F F N N H H O H 2 N H S IC50 = 150.0 nM 425.43 N#C[C@@]1(NC(=O)[C@@H](N)Cc2cccs2)C[C@@H]1c1ccccc1.O=C(O)C(F)(F)F Homo sapiens CHEMBL1007397 cell-based format
CHEMBL134068 OBDepict CH 3 NH H 3 C H 3 C O O O CH 3 H 3 C HN CH 3 O O IC50 = 160.0 nM 480.61 CCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CC)NC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL134268 OBDepict O O CH 3 H 3 C NH O O H 3 C H 3 C N H O IC50 = 170.0 nM 424.5 CC(C)(CNC(=O)c1ccccc1)C(=O)OC(=O)C(C)(C)CNC(=O)c1ccccc1 Homo sapiens CHEMBL661887 single protein format
CHEMBL130006 OBDepict H 3 C O O O N H H O H N O NH H 3 C H O N H H 3 C H O O O CH 3 Ki = 200.0 nM 560.6 COC(=O)CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)OC Homo sapiens CHEMBL661860 single protein format
CHEMBL130190 OBDepict H 3 C O O N H O H N O CH 3 H 3 C H HN O H O F F F Ki = 200.0 nM 527.54 COC(=O)CCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)C(F)(F)F)C(C)C Homo sapiens CHEMBL661860 single protein format
CHEMBL320132 OBDepict CH 3 N H H 3 C H 3 C HN O H O O H 3 C O N IC50 = 200.0 nM 519.69 CCCCCCC(NC(=O)c1ccc(C#N)cc1)C(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCCC Homo sapiens CHEMBL661877 single protein format
CHEMBL308215 OBDepict H 3 C H 3 C S N O O O O N IC50 = 220.0 nM 344.39 Cc1ccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)cc1C Homo sapiens CHEMBL661885 single protein format
CHEMBL304729 OBDepict Cl Cl S N O O O O N IC50 = 230.0 nM 385.23 O=C1CN(c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL661885 single protein format
CHEMBL55210 OBDepict CH 3 O N H O H N O CH 3 H 3 C H NH O H O CH 3 H 3 C F F F Ki = 250.0 nM 499.53 COc1ccc(C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)C(F)(F)F)C(C)C)C(C)C)cc1 Homo sapiens CHEMBL661896 single protein format
CHEMBL68946 OBDepict N S N O O O O N IC50 = 330.0 nM 341.35 N#Cc1ccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)cc1 Homo sapiens CHEMBL661885 single protein format
CHEMBL69677 OBDepict H 3 C O O S N O O O O N IC50 = 340.0 nM 374.37 COC(=O)c1ccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)cc1 Homo sapiens CHEMBL661885 single protein format
CHEMBL26285 OBDepict H 3 C O N N O NH 2 N H O O O N O O CH 3 Ki = 379.0 nM 581.59 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4cccc(OC)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL820310 single protein format
CHEMBL325041 OBDepict H 3 C CH 3 B NH H OH OH O N H H O N N IC50 = 520.0 nM 384.25 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O Homo sapiens CHEMBL933247 single protein format
CHEMBL4103492 OBDepict CH 3 N H N H O O H N H H O OH H 3 C H O NH 2 H O HO Ki = 530.0 nM 478.55 CCCCC(NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL4052990 single protein format
CHEMBL305066 OBDepict Br S N O O O O N IC50 = 600.0 nM 395.23 O=C1CN(c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(Br)cc1 Homo sapiens CHEMBL661885 single protein format
CHEMBL325041 OBDepict H 3 C CH 3 B NH H OH OH O N H H O N N Ki = 630.0 nM 384.25 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O Homo sapiens CHEMBL661898 single protein format
CHEMBL4100180 OBDepict H 3 C NH HN O O H N H H O O NH 2 H O HO O HO Ki = 630.0 nM 506.56 CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL4052990 single protein format
CHEMBL304838 OBDepict H 3 C O O S N O O O O N IC50 = 640.0 nM 374.37 COC(=O)c1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1 Homo sapiens CHEMBL661885 single protein format
CHEMBL69991 OBDepict Cl S N O O O O N IC50 = 700.0 nM 350.78 O=C1CN(c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL661885 single protein format
CHEMBL281124 OBDepict H 3 C O O N O O HN O N O N NH 2 F Ki = 720.0 nM 569.55 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4ccc(F)cc4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL820310 single protein format
CHEMBL298276 OBDepict H 3 C N O N O H 3 C IC50 = 740.0 nM 142.16 CCN1C(=O)N(CC)C1=O Homo sapiens CHEMBL661876 single protein format
CHEMBL431187 OBDepict N S N O O O O N IC50 = 780.0 nM 341.35 N#Cc1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1 Homo sapiens CHEMBL661885 single protein format
CHEMBL167990 OBDepict O N H N H 3 C O O P O HO OH IC50 = 800.0 nM 594.6 CN(CCCNC(=O)c1ccccc1)C(=O)c1cc2ccccc2cc1C(=O)C(c1cccc2ccccc12)P(=O)(O)O Homo sapiens CHEMBL661888 single protein format
CHEMBL351456 OBDepict CH 3 N O O P O OH OH IC50 = 1000.0 nM 523.53 CN(Cc1ccccc1)C(=O)c1cc2ccccc2cc1C(=O)C(c1cccc2ccccc12)P(=O)(O)O Homo sapiens CHEMBL661888 single protein format
CHEMBL66504 OBDepict HO O S N O O O O N IC50 = 1000.0 nM 360.35 O=C(O)c1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1 Homo sapiens CHEMBL661885 single protein format