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P04054 | PA21B_HUMAN | Phospholipase A2 (PLA2G1B)

3D structures mapped by conservation among orthologs

[ Domain: "Phospholipase A2, PLA2" // Phospholip_A2_1 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL121609 OBDepict H 3 C N O O H 2 N O O HO IC50 = 5.0 nM 430.46 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc2ccccc12 Homo sapiens CHEMBL760952 single protein format
CHEMBL121245 OBDepict H 3 C N O O H 2 N O Cl O OH IC50 = 6.0 nM 414.85 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc(Cl)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL331755 OBDepict CH 3 N O O NH 2 O O HO IC50 = 6.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1Cc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL332993 OBDepict H 3 C N O O H 2 N O O OH IC50 = 6.0 nM 456.5 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121627 OBDepict CH 3 O O O N O H 3 C O NH 2 IC50 = 8.0 nM 456.5 COC(=O)COc1cccn2c(Cc3ccccc3-c3ccccc3)c(C)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL332547 OBDepict OH O O N O H 3 C O NH 2 IC50 = 8.0 nM 366.37 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121617 OBDepict CH 3 N O O NH 2 O O OH IC50 = 8.0 nM 380.4 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120112 OBDepict H 3 C N O O H 2 N O F F F O OH IC50 = 9.0 nM 448.4 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121645 OBDepict HO O O N O O NH 2 IC50 = 9.0 nM 468.51 NC(=O)C(=O)c1c(C2CC2)c(Cc2ccccc2-c2ccccc2)n2cccc(OCC(=O)O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL332957 OBDepict H 3 C O O O N O O NH 2 CH 3 IC50 = 9.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)OC)cccn2c1Cc1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL123182 OBDepict H 3 C N O O H 2 N O S S O OH IC50 = 10.0 nM 468.56 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1csc(-c2cccs2)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL414424 OBDepict OH O O N O H 3 C O NH 2 IC50 = 10.0 nM 372.42 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC1CCCCC1 Homo sapiens CHEMBL760952 single protein format
CHEMBL123774 OBDepict CH 3 N CH 3 O O O NH 2 O OH IC50 = 11.0 nM 436.51 CCCCc1ccc(Cc2c(CC)c(C(=O)C(N)=O)c3c(OCC(=O)O)cccn23)cc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL122736 OBDepict H 3 C N O S O H 2 N O O OH IC50 = 11.0 nM 386.43 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccs1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121030 OBDepict H 2 N O N O O OH IC50 = 13.0 nM 454.53 NC(=O)Cc1c(C2CC2)c(Cc2ccccc2-c2ccccc2)n2cccc(OCC(=O)O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL123384 OBDepict H 3 C N O H 2 N O O OH IC50 = 13.0 nM 366.42 CCc1c(CC(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121481 OBDepict CH 3 N O NH 2 O O HO IC50 = 14.0 nM 442.52 CCc1c(CC(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL330987 OBDepict HO O O N O CH 3 O NH 2 IC50 = 14.0 nM 358.39 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC1CCCC1 Homo sapiens CHEMBL760952 single protein format
CHEMBL420169 OBDepict H 3 C O N O O H 2 N O O OH IC50 = 15.0 nM 458.47 COc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121199 OBDepict H 3 C N O H 2 N O Cl O OH IC50 = 15.0 nM 400.86 CCc1c(CC(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc(Cl)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121605 OBDepict H 3 C S N O O H 2 N O O OH IC50 = 16.0 nM 474.54 CSc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL123394 OBDepict H 3 C H 3 C N H 3 C O O O H 2 N O HO IC50 = 17.0 nM 374.44 CCCC(C)Cc1c(CC)c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn12 Homo sapiens CHEMBL760952 single protein format
CHEMBL121422 OBDepict H 3 C N O O H 2 N O O HO IC50 = 17.0 nM 430.46 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccc2ccccc2c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120111 OBDepict CH 3 O O O N O O NH 2 H 3 C IC50 = 17.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)OC)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL332393 OBDepict CH 3 N O O NH 2 O O OH IC50 = 18.0 nM 456.5 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL334242 OBDepict H 3 C N O O H 2 N O O OH IC50 = 19.0 nM 372.42 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC1CCCC1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120553 OBDepict CH 3 N O O NH 2 O O H 3 C O OH IC50 = 21.0 nM 410.43 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc(OC)c1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120909 OBDepict CH 3 N O O NH 2 O O OH IC50 = 21.0 nM 386.45 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC1CCCCC1 Homo sapiens CHEMBL760952 single protein format
CHEMBL332532 OBDepict H 3 C O O O N O O H 2 N IC50 = 23.0 nM 456.5 COC(=O)COc1cccn2c(Cc3cccc4ccccc34)c(C3CC3)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL330844 OBDepict H 3 C N O O H 2 N O O HO IC50 = 23.0 nM 400.48 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC1CCCCCC1 Homo sapiens CHEMBL760952 single protein format
CHEMBL331184 OBDepict H 3 C H N CH 3 O O O H 2 N O HO IC50 = 25.0 nM 456.58 CCCCC[C@H]1CCCC(Cc2c(CC)c(C(=O)C(N)=O)c3c(OCC(=O)O)cccn23)C1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120850 OBDepict HO O O N O O H 2 N IC50 = 29.0 nM 384.43 NC(=O)C(=O)c1c(C2CC2)c(CC2CCCC2)n2cccc(OCC(=O)O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL338054 OBDepict CH 3 N O NH 2 O O OH IC50 = 30.0 nM 402.45 CCc1c(C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1cccc2ccccc12 Homo sapiens CHEMBL760952 single protein format
CHEMBL332073 OBDepict H 3 C O O O N O O H 2 N H 3 C CH 3 IC50 = 35.0 nM 484.55 COC(=O)COc1cccn2c(Cc3ccccc3-c3ccccc3)c(C(C)C)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL119969 OBDepict CH 3 N O O NH 2 O + N O _ O O OH IC50 = 36.0 nM 425.4 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1Cc1ccccc1[N+](=O)[O-] Homo sapiens CHEMBL760952 single protein format
CHEMBL120884 OBDepict H 3 C O O O N O O NH 2 H 3 C IC50 = 38.0 nM 420.47 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)OC)cccn2c1C/C=C/c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL121664 OBDepict H 3 C O O O N O O NH 2 IC50 = 43.0 nM 412.49 COC(=O)COc1cccn2c(CC3CCCCC3)c(C3CC3)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL123343 OBDepict CH 3 N O O NH 2 O O OH IC50 = 44.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2c(OCCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL123334 OBDepict CH 3 N O O NH 2 O N IC50 = 46.0 nM 489.58 CCc1c(C(=O)C(N)=O)c2c(OCc3ccccn3)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL120899 OBDepict OH O O N O O NH 2 IC50 = 46.0 nM 392.41 NC(=O)C(=O)c1c(C2CC2)c(Cc2ccccc2)n2cccc(OCC(=O)O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL121652 OBDepict H 3 C N O O H 2 N O O OH IC50 = 51.0 nM 394.43 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CCc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL331678 OBDepict CH 3 O O O N O O NH 2 H 3 C IC50 = 51.0 nM 408.45 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)OC)cccn2c1CCc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL333869 OBDepict CH 3 N CH 3 O O O NH 2 O OH IC50 = 62.0 nM 360.41 CCCCCc1c(CC)c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn12 Homo sapiens CHEMBL760952 single protein format
CHEMBL436456 OBDepict CH 3 N O O NH 2 O O HO IC50 = 62.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1ccccc1Cc1ccccc1 Homo sapiens CHEMBL760630 single protein format
CHEMBL332877 OBDepict H 3 C N O H 2 N O O OH IC50 = 80.0 nM 470.57 CCc1c(CC(N)=O)c2c(OCCCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL148649 OBDepict H 3 C N O O H 2 N O H 3 C O HO IC50 = 80.0 nM 394.43 CCc1c(C(=O)C(N)=O)c2c(OC(C)C(=O)O)cccc2n1Cc1ccccc1 Homo sapiens CHEMBL990824 single protein format
CHEMBL122718 OBDepict CH 3 N O O NH 2 O O HO IC50 = 80.0 nM 484.55 CCc1c(C(=O)C(N)=O)c2c(OCCCC(=O)O)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL333803 OBDepict H 3 C N O O H 2 N O N IC50 = 83.0 nM 489.58 CCc1c(C(=O)C(N)=O)c2c(OCc3ccncc3)cccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL515637 OBDepict H 3 C N O O H 2 N O O OH IC50 = 84.0 nM 430.46 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cc3ccccc3c2n1Cc1ccccc1 Homo sapiens CHEMBL990824 single protein format
CHEMBL120881 OBDepict H 3 C O O O N O O H 2 N CH 3 CH 3 H 3 C IC50 = 100.0 nM 498.58 COC(=O)COc1cccn2c(Cc3ccccc3-c3ccccc3)c(C(C)(C)C)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL121152 OBDepict HO O O N O CH 3 O H 2 N H H H IC50 = 120.0 nM 424.5 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccn2c1CC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3 Homo sapiens CHEMBL760952 single protein format
CHEMBL2111800 OBDepict CH 3 N O O NH 2 O O OH IC50 = 140.0 nM 484.55 CCc1c(C(=O)C(N)=O)c2cc(OCCCC(=O)O)ccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL333691 OBDepict H 3 C N O O H 2 N O O OH IC50 = 200.0 nM 408.45 CCc1c(C(=O)C(N)=O)c2c(OCCCC(=O)O)cccn2c1Cc1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL148674 OBDepict H 3 C N O O H 2 N O O OH IC50 = 228.0 nM 380.4 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1ccccc1 Homo sapiens CHEMBL760630 single protein format
CHEMBL2111798 OBDepict H 3 C N O O H 2 N O O HO IC50 = 240.0 nM 470.53 CCc1c(C(=O)C(N)=O)c2cc(OCCC(=O)O)ccn2c1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760952 single protein format
CHEMBL331283 OBDepict CH 3 O O O N O O NH 2 IC50 = 280.0 nM 510.59 COC(=O)COc1cccn2c(Cc3ccccc3-c3ccccc3)c(C3CCCC3)c(C(=O)C(N)=O)c12 Homo sapiens CHEMBL760952 single protein format
CHEMBL357979 OBDepict HO O O N O CH 3 O H 2 N IC50 = 364.0 nM 442.47 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1ccccc1-c1ccccc1 Homo sapiens CHEMBL760630 single protein format
CHEMBL345986 OBDepict H 3 C N O O H 2 N O Cl O OH IC50 = 390.0 nM 414.85 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1cccc(Cl)c1 Homo sapiens CHEMBL764625 single protein format
CHEMBL355944 OBDepict OH O O N O H 3 C O NH 2 IC50 = 570.0 nM 442.47 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL760630 single protein format
CHEMBL346196 OBDepict OH O O N O H 3 C O NH 2 IC50 = 761.0 nM 366.37 Cc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1ccccc1 Homo sapiens CHEMBL760630 single protein format
CHEMBL433701 OBDepict CH 3 N CH 3 O O O NH 2 O OH IC50 = 780.0 nM 388.46 CCCCCCCCn1c(C)c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc21 Homo sapiens CHEMBL760629 single protein format
CHEMBL208315 OBDepict H 3 C N O O H 2 N O CH 3 O OH IC50 = 800.0 nM 394.43 CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cc(C)cc2n1Cc1ccccc1 Homo sapiens CHEMBL862122 single protein format
CHEMBL514841 OBDepict CH 3 O N O O H 2 N CH 3 IC50 = 810.0 nM 386.45 CCc1c(C(=O)C(N)=O)c2c(OC)cc3ccccc3c2n1Cc1ccccc1 Homo sapiens CHEMBL990824 single protein format