Found 22 hits Enz. Inhib. hit(s) with all data for entry = 50034734 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM50280987
(1N-[12-isopropyl-2,6-dimethyltricyclo[8.4.0.02,7]t...)Show SMILES CC(N)CCCNC[C@]1(C)CCC[C@@]2(C)C1CCc1cc(ccc21)C(C)C |r| Show InChI InChI=1S/C25H42N2/c1-18(2)20-9-11-22-21(16-20)10-12-23-24(4,13-7-14-25(22,23)5)17-27-15-6-8-19(3)26/h9,11,16,18-19,23,27H,6-8,10,12-15,17,26H2,1-5H3/t19?,23?,24-,25+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM17638
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | PDB
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| PDB Article
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50280987
(1N-[12-isopropyl-2,6-dimethyltricyclo[8.4.0.02,7]t...)Show SMILES CC(N)CCCNC[C@]1(C)CCC[C@@]2(C)C1CCc1cc(ccc21)C(C)C |r| Show InChI InChI=1S/C25H42N2/c1-18(2)20-9-11-22-21(16-20)10-12-23-24(4,13-7-14-25(22,23)5)17-27-15-6-8-19(3)26/h9,11,16,18-19,23,27H,6-8,10,12-15,17,26H2,1-5H3/t19?,23?,24-,25+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 5.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM50280984
(C-((4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CC[C@H]3C(C)(CN)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18-,19?,20+/m0/s1 | PDB MMDB
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| n/a | n/a | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50280984
(C-((4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CC[C@H]3C(C)(CN)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18-,19?,20+/m0/s1 | PDB MMDB
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| Article
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM50280986
(CHEMBL293419 | N-[3-Acetylamino-3-(4-fluoro-phenyl...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CN(CCC(NC(C)=O)c4ccc(F)cc4)C(C)=O)CCC[C@]23C)c1 Show InChI InChI=1S/C33H45FN2O2/c1-22(2)26-10-14-29-27(20-26)11-15-31-32(5,17-7-18-33(29,31)6)21-36(24(4)38)19-16-30(35-23(3)37)25-8-12-28(34)13-9-25/h8-10,12-14,20,22,30-31H,7,11,15-19,21H2,1-6H3,(H,35,37)/t30?,31?,32-,33+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM50280985
(2-{[((1R,4aS)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CNCc4ccccc4C(O)=O)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C28H37NO2/c1-19(2)20-10-12-24-21(16-20)11-13-25-27(3,14-7-15-28(24,25)4)18-29-17-22-8-5-6-9-23(22)26(30)31/h5-6,8-10,12,16,19,25,29H,7,11,13-15,17-18H2,1-4H3,(H,30,31)/t25?,27-,28+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50280988
(CHEMBL542142 | N-tetrahydro-1H-2-pyrrolylmethyl-12...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CNCC4CCCN4)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C25H40N2/c1-18(2)19-8-10-22-20(15-19)9-11-23-24(3,12-6-13-25(22,23)4)17-26-16-21-7-5-14-27-21/h8,10,15,18,21,23,26-27H,5-7,9,11-14,16-17H2,1-4H3/t21?,23?,24-,25+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
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| Article
| n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50015214
(6-chloro-2-methoxy-9-acridinyl(4-diethylamino-1-me...)Show SMILES CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12 Show InChI InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26) | PDB
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CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
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| Article
| n/a | n/a | 3.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50280985
(2-{[((1R,4aS)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CNCc4ccccc4C(O)=O)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C28H37NO2/c1-19(2)20-10-12-24-21(16-20)11-13-25-27(3,14-7-15-28(24,25)4)18-29-17-22-8-5-6-9-23(22)26(30)31/h5-6,8-10,12,16,19,25,29H,7,11,13-15,17-18H2,1-4H3,(H,30,31)/t25?,27-,28+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | 3.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50280988
(CHEMBL542142 | N-tetrahydro-1H-2-pyrrolylmethyl-12...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CNCC4CCCN4)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C25H40N2/c1-18(2)19-8-10-22-20(15-19)9-11-23-24(3,12-6-13-25(22,23)4)17-26-16-21-7-5-14-27-21/h8,10,15,18,21,23,26-27H,5-7,9,11-14,16-17H2,1-4H3/t21?,23?,24-,25+/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 6.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50280984
(C-((4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CC[C@H]3C(C)(CN)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18-,19?,20+/m0/s1 | PDB
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| n/a | n/a | 7.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50280986
(CHEMBL293419 | N-[3-Acetylamino-3-(4-fluoro-phenyl...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CN(CCC(NC(C)=O)c4ccc(F)cc4)C(C)=O)CCC[C@]23C)c1 Show InChI InChI=1S/C33H45FN2O2/c1-22(2)26-10-14-29-27(20-26)11-15-31-32(5,17-7-18-33(29,31)6)21-36(24(4)38)19-16-30(35-23(3)37)25-8-12-28(34)13-9-25/h8-10,12-14,20,22,30-31H,7,11,15-19,21H2,1-6H3,(H,35,37)/t30?,31?,32-,33+/m0/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | 9.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM50015214
(6-chloro-2-methoxy-9-acridinyl(4-diethylamino-1-me...)Show SMILES CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12 Show InChI InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26) | PDB MMDB
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| Article
| n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM18207
((1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dih...)Show SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24| Show InChI InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1 | PDB MMDB
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Patents
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| n/a | n/a | 1.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50280986
(CHEMBL293419 | N-[3-Acetylamino-3-(4-fluoro-phenyl...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CN(CCC(NC(C)=O)c4ccc(F)cc4)C(C)=O)CCC[C@]23C)c1 Show InChI InChI=1S/C33H45FN2O2/c1-22(2)26-10-14-29-27(20-26)11-15-31-32(5,17-7-18-33(29,31)6)21-36(24(4)38)19-16-30(35-23(3)37)25-8-12-28(34)13-9-25/h8-10,12-14,20,22,30-31H,7,11,15-19,21H2,1-6H3,(H,35,37)/t30?,31?,32-,33+/m0/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | 1.24E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM50015214
(6-chloro-2-methoxy-9-acridinyl(4-diethylamino-1-me...)Show SMILES CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12 Show InChI InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26) | PDB MMDB
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CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
Patents
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| n/a | n/a | 1.30E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50280985
(2-{[((1R,4aS)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a...)Show SMILES CC(C)c1ccc2c(CCC3[C@](C)(CNCc4ccccc4C(O)=O)CCC[C@]23C)c1 |r| Show InChI InChI=1S/C28H37NO2/c1-19(2)20-10-12-24-21(16-20)11-13-25-27(3,14-7-15-28(24,25)4)18-29-17-22-8-5-6-9-23(22)26(30)31/h5-6,8-10,12,16,19,25,29H,7,11,13-15,17-18H2,1-4H3,(H,30,31)/t25?,27-,28+/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article
| n/a | n/a | 2.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus) | BDBM17638
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | PDB MMDB
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article
| n/a | n/a | >2.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against 5-lipoxygenase |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM17638
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article
| n/a | n/a | 2.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1/2
(Bos taurus) | BDBM50280987
(1N-[12-isopropyl-2,6-dimethyltricyclo[8.4.0.02,7]t...)Show SMILES CC(N)CCCNC[C@]1(C)CCC[C@@]2(C)C1CCc1cc(ccc21)C(C)C |r| Show InChI InChI=1S/C25H42N2/c1-18(2)20-9-11-22-21(16-20)10-12-23-24(4,13-7-14-25(22,23)5)17-27-15-6-8-19(3)26/h9,11,16,18-19,23,27H,6-8,10,12-15,17,26H2,1-5H3/t19?,23?,24-,25+/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 3.90E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against PGS (prostaglandin synthetase). |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |
Phospholipase A2, major isoenzyme
(Sus scrofa (pig)) | BDBM18207
((1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dih...)Show SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24| Show InChI InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
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DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article
| n/a | n/a | >7.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Tested for its inhibitory activity against Phospholipase A2 (PLA2) |
Bioorg Med Chem Lett 3: 2087-2092 (1993)
Article DOI: 10.1016/S0960-894X(01)81022-2 BindingDB Entry DOI: 10.7270/Q2G73F6K |
More data for this Ligand-Target Pair | |