Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50005533 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 |
|---|
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029623
(1-chloro-4-[2-(4-methylsulfonylphenyl)-1-cyclopent...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(Cl)cc1 |t:11| Show InChI InChI=1S/C18H17ClO2S/c1-22(20,21)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(19)10-6-13/h5-12H,2-4H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029625
(1-methyl-4-[2-(4-methylsulfonylphenyl)-1-cyclopent...)Show SMILES Cc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:8| Show InChI InChI=1S/C19H20O2S/c1-14-6-8-15(9-7-14)18-4-3-5-19(18)16-10-12-17(13-11-16)22(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029613
(1-Methoxy-4-(2-(4-(methanesulfonyl)phenyl)cyclopen...)Show SMILES COc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H20O3S/c1-22-16-10-6-14(7-11-16)18-4-3-5-19(18)15-8-12-17(13-9-15)23(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037941
(1-[4,4-dimethyl-2-(4-methylsulfonylphenyl)-1-cyclo...)Show SMILES CC1(C)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1 |c:4| Show InChI InChI=1S/C20H21ClO2S/c1-20(2)12-18(14-4-8-16(21)9-5-14)19(13-20)15-6-10-17(11-7-15)24(3,22)23/h4-11H,12-13H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029593
(CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...)Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037945
(1-[2-(4-fluorophenyl)-4,4-dimethyl-1-cyclopentenyl...)Show SMILES CC1(C)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:4| Show InChI InChI=1S/C20H21FO2S/c1-20(2)12-18(14-4-8-16(21)9-5-14)19(13-20)15-6-10-17(11-7-15)24(3,22)23/h4-11H,12-13H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029614
((SC-57666)1-[2-(4-fluorophenyl)-1-cyclopentenyl]-4...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C18H17FO2S/c1-22(20,21)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(19)10-6-13/h5-12H,2-4H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037942
(1-[4,4-bis(fluoromethyl)-2-(4-fluorophenyl)cyclope...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CC(CF)(CF)C1)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C20H19F3O2S/c1-26(24,25)17-8-4-15(5-9-17)19-11-20(12-21,13-22)10-18(19)14-2-6-16(23)7-3-14/h2-9H,10-13H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037951
(2,4-Dichloro-1-[2-(4-methanesulfonyl-phenyl)-cyclo...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(Cl)cc1Cl |t:11| Show InChI InChI=1S/C18H16Cl2O2S/c1-23(21,22)14-8-5-12(6-9-14)15-3-2-4-16(15)17-10-7-13(19)11-18(17)20/h5-11H,2-4H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037950
(1-fluoro-4-[2-(4-methylsulfonylphenyl)-4,4-di(trif...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CC(C1)(C(F)(F)F)C(F)(F)F)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C20H15F7O2S/c1-30(28,29)15-8-4-13(5-9-15)17-11-18(19(22,23)24,20(25,26)27)10-16(17)12-2-6-14(21)7-3-12/h2-9H,10-11H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037940
(4-Fluoro-1-[2-(4-methanesulfonyl-phenyl)-cyclopent...)Show SMILES Cc1cc(F)ccc1C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H19FO2S/c1-13-12-15(20)8-11-17(13)19-5-3-4-18(19)14-6-9-16(10-7-14)23(2,21)22/h6-12H,3-5H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029616
(5-(4-Fluoro-phenyl)-1-(4-methanesulfonyl-phenyl)-3...)Show SMILES CS(=O)(=O)c1ccc(cc1)-n1nc(cc1-c1ccc(F)cc1)C(F)(F)F Show InChI InChI=1S/C17H12F4N2O2S/c1-26(24,25)14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | 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
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037946
(1-(methylsulfonyl)-4-{2-[4-(methylthio)phenyl]cycl...)Show SMILES CSc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H20O2S2/c1-22-16-10-6-14(7-11-16)18-4-3-5-19(18)15-8-12-17(13-9-15)23(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 221 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029610
(1-(methylsulfonyl)-4-{2-[4-(trifluoromethyl)phenyl...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(cc1)C(F)(F)F |t:11| Show InChI InChI=1S/C19H17F3O2S/c1-25(23,24)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(10-6-13)19(20,21)22/h5-12H,2-4H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 865 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | 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
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037941
(1-[4,4-dimethyl-2-(4-methylsulfonylphenyl)-1-cyclo...)Show SMILES CC1(C)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1 |c:4| Show InChI InChI=1S/C20H21ClO2S/c1-20(2)12-18(14-4-8-16(21)9-5-14)19(13-20)15-6-10-17(11-7-15)24(3,22)23/h4-11H,12-13H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037943
(1-Methanesulfonyl-4-(2-phenyl-cyclopent-1-enyl)-be...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccccc1 |t:11| Show InChI InChI=1S/C18H18O2S/c1-21(19,20)16-12-10-15(11-13-16)18-9-5-8-17(18)14-6-3-2-4-7-14/h2-4,6-7,10-13H,5,8-9H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037949
((4-{2-[4-(methylsulfonyl)phenyl]cyclopent-1-en-1-y...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(CO)cc1 |t:11| Show InChI InChI=1S/C19H20O3S/c1-23(21,22)17-11-9-16(10-12-17)19-4-2-3-18(19)15-7-5-14(13-20)6-8-15/h5-12,20H,2-4,13H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037947
(1-(methoxymethyl)-4-{2-[4-(methylsulfonyl)phenyl]c...)Show SMILES COCc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:10| Show InChI InChI=1S/C20H22O3S/c1-23-14-15-6-8-16(9-7-15)19-4-3-5-20(19)17-10-12-18(13-11-17)24(2,21)22/h6-13H,3-5,14H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029613
(1-Methoxy-4-(2-(4-(methanesulfonyl)phenyl)cyclopen...)Show SMILES COc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H20O3S/c1-22-16-10-6-14(7-11-16)18-4-3-5-19(18)15-8-12-17(13-9-15)23(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
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| n/a | n/a | 9.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029593
(CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...)Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037945
(1-[2-(4-fluorophenyl)-4,4-dimethyl-1-cyclopentenyl...)Show SMILES CC1(C)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:4| Show InChI InChI=1S/C20H21FO2S/c1-20(2)12-18(14-4-8-16(21)9-5-14)19(13-20)15-6-10-17(11-7-15)24(3,22)23/h4-11H,12-13H2,1-3H3 | PDB
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| n/a | n/a | 1.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037942
(1-[4,4-bis(fluoromethyl)-2-(4-fluorophenyl)cyclope...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CC(CF)(CF)C1)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C20H19F3O2S/c1-26(24,25)17-8-4-15(5-9-17)19-11-20(12-21,13-22)10-18(19)14-2-6-16(23)7-3-14/h2-9H,10-13H2,1H3 | PDB
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| n/a | n/a | 5.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037944
(1-[4,4-diethyl-2-(4-methylsulfonylphenyl)-1-cyclop...)Show SMILES CCC1(CC)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:6| Show InChI InChI=1S/C22H25FO2S/c1-4-22(5-2)14-20(16-6-10-18(23)11-7-16)21(15-22)17-8-12-19(13-9-17)26(3,24)25/h6-13H,4-5,14-15H2,1-3H3 | PDB
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Reactome pathway
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| n/a | n/a | 6.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50037948
(4-[2-(4-Methanesulfonyl-phenyl)-cyclopent-1-enyl]-...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(cc1)C#N |t:11| Show InChI InChI=1S/C19H17NO2S/c1-23(21,22)17-11-9-16(10-12-17)19-4-2-3-18(19)15-7-5-14(13-20)6-8-15/h5-12H,2-4H2,1H3 | PDB
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| n/a | n/a | 7.79E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 2 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037944
(1-[4,4-diethyl-2-(4-methylsulfonylphenyl)-1-cyclop...)Show SMILES CCC1(CC)CC(=C(C1)c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:6| Show InChI InChI=1S/C22H25FO2S/c1-4-22(5-2)14-20(16-6-10-18(23)11-7-16)21(15-22)17-8-12-19(13-9-17)26(3,24)25/h6-13H,4-5,14-15H2,1-3H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029614
((SC-57666)1-[2-(4-fluorophenyl)-1-cyclopentenyl]-4...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C18H17FO2S/c1-22(20,21)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(19)10-6-13/h5-12H,2-4H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037940
(4-Fluoro-1-[2-(4-methanesulfonyl-phenyl)-cyclopent...)Show SMILES Cc1cc(F)ccc1C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H19FO2S/c1-13-12-15(20)8-11-17(13)19-5-3-4-18(19)14-6-9-16(10-7-14)23(2,21)22/h6-12H,3-5H2,1-2H3 | PDB
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Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037949
((4-{2-[4-(methylsulfonyl)phenyl]cyclopent-1-en-1-y...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(CO)cc1 |t:11| Show InChI InChI=1S/C19H20O3S/c1-23(21,22)17-11-9-16(10-12-17)19-4-2-3-18(19)15-7-5-14(13-20)6-8-15/h5-12,20H,2-4,13H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037948
(4-[2-(4-Methanesulfonyl-phenyl)-cyclopent-1-enyl]-...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(cc1)C#N |t:11| Show InChI InChI=1S/C19H17NO2S/c1-23(21,22)17-11-9-16(10-12-17)19-4-2-3-18(19)15-7-5-14(13-20)6-8-15/h5-12H,2-4H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037946
(1-(methylsulfonyl)-4-{2-[4-(methylthio)phenyl]cycl...)Show SMILES CSc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C19H20O2S2/c1-22-16-10-6-14(7-11-16)18-4-3-5-19(18)15-8-12-17(13-9-15)23(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037950
(1-fluoro-4-[2-(4-methylsulfonylphenyl)-4,4-di(trif...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CC(C1)(C(F)(F)F)C(F)(F)F)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C20H15F7O2S/c1-30(28,29)15-8-4-13(5-9-15)17-11-18(19(22,23)24,20(25,26)27)10-16(17)12-2-6-14(21)7-3-12/h2-9H,10-11H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037947
(1-(methoxymethyl)-4-{2-[4-(methylsulfonyl)phenyl]c...)Show SMILES COCc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:10| Show InChI InChI=1S/C20H22O3S/c1-23-14-15-6-8-16(9-7-15)19-4-3-5-20(19)17-10-12-18(13-11-17)24(2,21)22/h6-13H,3-5,14H2,1-2H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029625
(1-methyl-4-[2-(4-methylsulfonylphenyl)-1-cyclopent...)Show SMILES Cc1ccc(cc1)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:8| Show InChI InChI=1S/C19H20O2S/c1-14-6-8-15(9-7-14)18-4-3-5-19(18)16-10-12-17(13-11-16)22(2,20)21/h6-13H,3-5H2,1-2H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029616
(5-(4-Fluoro-phenyl)-1-(4-methanesulfonyl-phenyl)-3...)Show SMILES CS(=O)(=O)c1ccc(cc1)-n1nc(cc1-c1ccc(F)cc1)C(F)(F)F Show InChI InChI=1S/C17H12F4N2O2S/c1-26(24,25)14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029610
(1-(methylsulfonyl)-4-{2-[4-(trifluoromethyl)phenyl...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(cc1)C(F)(F)F |t:11| Show InChI InChI=1S/C19H17F3O2S/c1-25(23,24)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(10-6-13)19(20,21)22/h5-12H,2-4H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037951
(2,4-Dichloro-1-[2-(4-methanesulfonyl-phenyl)-cyclo...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(Cl)cc1Cl |t:11| Show InChI InChI=1S/C18H16Cl2O2S/c1-23(21,22)14-8-5-12(6-9-14)15-3-2-4-16(15)17-10-7-13(19)11-18(17)20/h5-11H,2-4H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50029623
(1-chloro-4-[2-(4-methylsulfonylphenyl)-1-cyclopent...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccc(Cl)cc1 |t:11| Show InChI InChI=1S/C18H17ClO2S/c1-22(20,21)16-11-7-14(8-12-16)18-4-2-3-17(18)13-5-9-15(19)10-6-13/h5-12H,2-4H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50037943
(1-Methanesulfonyl-4-(2-phenyl-cyclopent-1-enyl)-be...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(CCC1)c1ccccc1 |t:11| Show InChI InChI=1S/C18H18O2S/c1-21(19,20)16-12-10-15(11-13-16)18-9-5-8-17(18)14-6-3-2-4-7-14/h2-4,6-7,10-13H,5,8-9H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Research & Development
Curated by ChEMBL
| Assay Description
Tested for inhibition against Prostaglandin G/H synthase 1 |
J Med Chem 37: 3878-81 (1994)
BindingDB Entry DOI: 10.7270/Q26D5S1G |
More data for this
Ligand-Target Pair | |
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