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Q9Y4D2 | DGLA_HUMAN | Diacylglycerol lipase-alpha (DAGLA)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL3764017 OBDepict OH O N S O O O H 3 C H 3 C Cl Cl IC50 = 0.6 nM 574.53 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)C3(c4cccc(-c5cc(Cl)cc(Cl)c5)c4)CCC3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765578 OBDepict OH O N S O O O H 3 C CH 3 Cl Cl IC50 = 0.9 nM 588.55 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)C3(c4cccc(-c5cc(Cl)cc(Cl)c5)c4)CCCC3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3764876 OBDepict HO O N S O O O F F Cl Cl IC50 = 2.4 nM 502.32 O=C(O)CN(c1cccc(-c2cccc(Cl)c2Cl)c1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3763826 OBDepict HO O N S O O O CH 3 CH 3 Cl Cl IC50 = 3.0 nM 534.46 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(-c4cc(Cl)cc(Cl)c4)c3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3763853 OBDepict HO O N S O O O F F Cl Cl IC50 = 3.0 nM 516.35 O=C(O)CN(Cc1cccc(-c2cccc(Cl)c2Cl)c1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765716 OBDepict HO O N S O O O H 3 C H 3 C Cl Cl IC50 = 3.0 nM 534.46 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3ccc(-c4cc(Cl)cc(Cl)c4)cc3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3763831 OBDepict OH O N S O O Cl Cl Cl IC50 = 4.0 nM 524.85 O=C(O)CN(C1(c2cccc(-c3cc(Cl)cc(Cl)c3)c2)CCC1)S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765421 OBDepict OH O N S O O O F F Cl Cl IC50 = 6.0 nM 556.41 O=C(O)CN(C1(c2ccc(-c3ccc(Cl)cc3Cl)cc2)CCC1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3764093 OBDepict HO O N S O O Cl Cl Cl Cl IC50 = 6.0 nM 559.3 O=C(O)CN(C1(c2cccc(-c3ccc(Cl)cc3Cl)c2)CCC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765022 OBDepict OH O N S O O O F F O F F F IC50 = 8.0 nM 571.52 O=C(O)CN(C1(c2ccc(-c3ccccc3OC(F)(F)F)cc2)CCC1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3763430 OBDepict OH O N S O O O H 3 C H 3 C O Cl Cl IC50 = 8.0 nM 590.53 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)C3(c4ccc(-c5cc(Cl)cc(Cl)c5)cc4)CCOC3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765158 OBDepict OH O N S O O O F F Cl Cl IC50 = 11.0 nM 556.41 O=C(O)CN(C1(c2cccc(-c3cc(Cl)cc(Cl)c3)c2)CCC1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL521157 OBDepict H 3 C O H H O O H N H H O H 3 C CH 3 O CH 3 IC50 = 16.0 nM 495.75 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@@H](NC=O)C(C)CC Homo sapiens CHEMBL982702 cell-based format
CHEMBL3765824 OBDepict HO O N S O O O F F Cl Cl IC50 = 16.0 nM 516.35 O=C(O)CN(Cc1cccc(-c2cc(Cl)cc(Cl)c2)c1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3764377 OBDepict HO O N S O O O F F O F F F IC50 = 17.0 nM 531.46 O=C(O)CN(Cc1cccc(-c2ccccc2OC(F)(F)F)c1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3764778 OBDepict HO O N S O O O F F O F F F IC50 = 17.0 nM 531.46 O=C(O)CN(Cc1ccc(-c2ccccc2OC(F)(F)F)cc1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765573 OBDepict HO O N S O O O F F CH 3 H Cl Cl IC50 = 18.0 nM 530.38 C[C@@H](c1ccc(-c2ccc(Cl)cc2Cl)cc1)N(CC(=O)O)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3319620 OBDepict HO O N S O O O H 3 C H 3 C O IC50 = 18.0 nM 481.57 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3ccc(Oc4ccccc4)cc3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3765497 OBDepict HO O N S O O O F F CH 3 H Cl Cl IC50 = 19.0 nM 530.38 C[C@H](c1ccc(-c2ccc(Cl)cc2Cl)cc1)N(CC(=O)O)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765546 OBDepict HO O N S O O O F F Cl Cl IC50 = 30.0 nM 516.35 O=C(O)CN(Cc1ccc(-c2ccc(Cl)cc2Cl)cc1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL457232 OBDepict H 3 C O H H O O H NH H O CH 3 CH 3 O CH 3 IC50 = 35.0 nM 481.72 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@@H](NC=O)C(C)C Homo sapiens CHEMBL982702 cell-based format
CHEMBL3764349 OBDepict OH O N S O O O F F O F F F IC50 = 40.0 nM 557.49 O=C(O)CN(C1(c2ccc(-c3ccccc3OC(F)(F)F)cc2)CC1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL516323 OBDepict CH 3 O H H O O H N H CH 3 H O O H 3 C IC50 = 43.0 nM 453.66 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](C)NC=O Homo sapiens CHEMBL982702 cell-based format
CHEMBL3765562 OBDepict N S N O O O HO Cl Cl IC50 = 45.0 nM 515.42 N#Cc1ccc(S(=O)(=O)N(CC(=O)O)C2(c3cccc(-c4cc(Cl)cc(Cl)c4)c3)CCC2)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3764044 OBDepict HO O N S O O O CH 3 CH 3 IC50 = 55.0 nM 465.57 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(-c4ccccc4)c3)ccc2O1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3319619 OBDepict HO O N S O O O H 3 C H 3 C O IC50 = 56.0 nM 481.57 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(Oc4ccccc4)c3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3763964 OBDepict Cl Cl N S O O Cl O OH IC50 = 60.0 nM 524.85 O=C(O)CN(C1(c2cccc(-c3cc(Cl)cc(Cl)c3)c2)CCC1)S(=O)(=O)c1cccc(Cl)c1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL158897 OBDepict O O N H N N H O O N IC50 = 60.0 nM 394.52 O=C(NCCCCCCNC(=O)ON=C1CCCCC1)ON=C1CCCCC1 Homo sapiens CHEMBL962982 cell-based format
CHEMBL3319622 OBDepict HO O N S O O O H 3 C H 3 C O N F F F IC50 = 65.0 nM 550.56 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3ccc(Oc4ccc(C(F)(F)F)cn4)cc3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3319625 OBDepict HO O N S O O Cl O IC50 = 66.0 nM 431.9 O=C(O)CN(Cc1ccc(Oc2ccccc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3765634 OBDepict HO O N S O O O F F IC50 = 80.0 nM 447.46 O=C(O)CN(Cc1ccc(-c2ccccc2)cc1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3765750 OBDepict OH O N S O O Cl Cl IC50 = 80.0 nM 490.41 O=C(O)CN(C1(c2cccc(-c3cc(Cl)cc(Cl)c3)c2)CCC1)S(=O)(=O)c1ccccc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3319623 OBDepict HO O N S O O Cl O IC50 = 91.0 nM 431.9 O=C(O)CN(Cc1cccc(Oc2ccccc2)c1)S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL484393 OBDepict H 3 C O H H O O H H N H O O CH 3 IC50 = 100.0 nM 465.68 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@@H]1CCC(=O)N1 Homo sapiens CHEMBL982702 cell-based format
CHEMBL3764007 OBDepict OH O N S O O O F F Cl Cl IC50 = 130.0 nM 542.39 O=C(O)CN(C1(c2ccc(-c3ccc(Cl)cc3Cl)cc2)CC1)S(=O)(=O)c1ccc(OC(F)F)cc1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL486037 OBDepict _ N + N N I HN O N N N N N O CH 3 CH 3 IC50 = 130.0 nM 441.19 CN(C)C(=O)n1nnnc1CNC(=O)c1ccc(N=[N+]=[N-])c(I)c1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL3319621 OBDepict HO O N S O O O H 3 C H 3 C O N F F F IC50 = 143.0 nM 550.56 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(Oc4ccc(C(F)(F)F)cn4)c3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3764430 OBDepict CH 3 O S N O O O OH Cl Cl IC50 = 161.0 nM 520.43 COc1cccc(S(=O)(=O)N(CC(=O)O)C2(c3cccc(-c4cc(Cl)cc(Cl)c4)c3)CCC2)c1 Homo sapiens CHEMBL3768666 cell-based format
CHEMBL3319618 OBDepict HO O N S O O O CH 3 CH 3 O IC50 = 185.0 nM 481.57 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3ccccc3Oc3ccccc3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL453043 OBDepict O NH N N N N N O H 3 C CH 3 IC50 = 200.0 nM 358.45 CN(C)C(=O)n1nnnc1CNC(=O)CCCCCCc1ccccc1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL3319629 OBDepict HO O N S O O Cl O N F F F IC50 = 302.0 nM 500.88 O=C(O)CN(Cc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL519874 OBDepict CH 3 N H 3 C N O N N N NH O IC50 = 340.0 nM 350.38 CN(C)C(=O)n1nnnc1CNC(=O)c1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL484215 OBDepict H 3 C O H H O O H N H H O H 3 C CH 3 O CH 3 CH 3 IC50 = 430.0 nM 509.77 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@@H](NC(C)=O)C(C)CC Homo sapiens CHEMBL982702 cell-based format
CHEMBL521467 OBDepict H 3 C O H H O O H NH H O CH 3 CH 3 O H 3 C CH 3 IC50 = 460.0 nM 495.75 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@@H](NC(C)=O)C(C)C Homo sapiens CHEMBL982702 cell-based format
CHEMBL505359 OBDepict CH 3 N H 3 C N O N N N IC50 = 500.0 nM 259.31 CN(C)C(=O)n1nnc(CCCc2ccccc2)n1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL3763708 OBDepict OH O N S O O Cl Cl Cl IC50 = 510.0 nM 524.85 O=C(O)CN(C1(c2cccc(-c3cc(Cl)cc(Cl)c3)c2)CCC1)S(=O)(=O)c1ccccc1Cl Homo sapiens CHEMBL3768666 cell-based format
CHEMBL485841 OBDepict H 3 C N CH 3 N O N N N IC50 = 510.0 nM 307.36 CN(C)C(=O)n1nnc(Cc2ccc(-c3ccccc3)cc2)n1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL3319637 OBDepict NH 2 N S O O O H 3 C H 3 C O IC50 = 512.0 nM 466.6 CC1(C)CCc2cc(S(=O)(=O)N(CCN)Cc3ccc(Oc4ccccc4)cc3)ccc2O1 Homo sapiens CHEMBL3373886 cell-based format
CHEMBL486039 OBDepict O NH N N N N N O H 3 C CH 3 IC50 = 570.0 nM 372.47 CN(C)C(=O)n1nnnc1CNC(=O)CCCCCCCc1ccccc1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL514886 OBDepict H 3 C O H H O O H O N H O CH 3 IC50 = 600.0 nM 453.66 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)CCNC=O Homo sapiens CHEMBL982702 cell-based format
CHEMBL504374 OBDepict CH 3 N CH 3 N O N N N IC50 = 600.0 nM 245.29 CN(C)C(=O)n1nnc(CCc2ccccc2)n1 Homo sapiens CHEMBL972195 cell-based format
CHEMBL4558419 OBDepict H 3 C O O O O P O F CH 3 H 3 C H 3 C IC50 = 690.0 nM 464.6 CCCCCCC/C=CCCCCCCCC(=O)OC(COC(C)C)COP(C)(=O)F Homo sapiens CHEMBL4427019 single protein format
CHEMBL3319626 OBDepict HO O N S O O Cl Cl O IC50 = 695.0 nM 466.34 O=C(O)CN(Cc1ccc(Oc2ccccc2)cc1)S(=O)(=O)c1c(Cl)cccc1Cl Homo sapiens CHEMBL3373886 cell-based format
CHEMBL3319620 OBDepict HO O N S O O O H 3 C H 3 C O Ki = 700.0 nM 481.57 CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3ccc(Oc4ccccc4)cc3)ccc2O1 Homo sapiens CHEMBL3373887 cell-based format
CHEMBL458828 OBDepict H 3 C O H H O O H N H O O H 3 C CH 3 IC50 = 800.0 nM 453.66 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)CNC(C)=O Homo sapiens CHEMBL982702 cell-based format
CHEMBL175247 OBDepict H 3 C O H H O O H N H H O CH 3 H 3 C O CH 3 IC50 = 1000.0 nM 495.75 CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O Homo sapiens CHEMBL982702 cell-based format