Found 138 hits Enz. Inhib. hit(s) with all data for entry = 50004859 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)) | BDBM50373604
(CHEMBL272605)Show SMILES Cc1ccccc1CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H18F3N3O2S/c1-13-5-3-4-6-15(13)12-24-18-11-17(20(21,22)23)25-19(26-18)14-7-9-16(10-8-14)29(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.74E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373604
(CHEMBL272605)Show SMILES Cc1ccccc1CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H18F3N3O2S/c1-13-5-3-4-6-15(13)12-24-18-11-17(20(21,22)23)25-19(26-18)14-7-9-16(10-8-14)29(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50486564
(CHEMBL2234866)Show SMILES Cn1cccc1CCCNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H21F3N4O2S/c1-27-12-4-6-15(27)5-3-11-24-18-13-17(20(21,22)23)25-19(26-18)14-7-9-16(10-8-14)30(2,28)29/h4,6-10,12-13H,3,5,11H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
| n/a | n/a | 2.51E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50486564
(CHEMBL2234866)Show SMILES Cn1cccc1CCCNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H21F3N4O2S/c1-27-12-4-6-15(27)5-3-11-24-18-13-17(20(21,22)23)25-19(26-18)14-7-9-16(10-8-14)30(2,28)29/h4,6-10,12-13H,3,5,11H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
| n/a | n/a | 2.51E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373545
(CHEMBL410524)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccccc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H15F3N4O2S/c19-18(20,21)15-10-16(23-11-12-4-2-1-3-5-12)25-17(24-15)13-6-8-14(9-7-13)28(22,26)27/h1-10H,11H2,(H2,22,26,27)(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373545
(CHEMBL410524)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccccc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H15F3N4O2S/c19-18(20,21)15-10-16(23-11-12-4-2-1-3-5-12)25-17(24-15)13-6-8-14(9-7-13)28(22,26)27/h1-10H,11H2,(H2,22,26,27)(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373540
(CHEMBL409468)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccco2)cc(n1)C(F)(F)F Show InChI InChI=1S/C16H13F3N4O3S/c17-16(18,19)13-8-14(21-9-11-2-1-7-26-11)23-15(22-13)10-3-5-12(6-4-10)27(20,24)25/h1-8H,9H2,(H2,20,24,25)(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.58E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373540
(CHEMBL409468)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccco2)cc(n1)C(F)(F)F Show InChI InChI=1S/C16H13F3N4O3S/c17-16(18,19)13-8-14(21-9-11-2-1-7-26-11)23-15(22-13)10-3-5-12(6-4-10)27(20,24)25/h1-8H,9H2,(H2,20,24,25)(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.58E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373603
(CHEMBL272587)Show SMILES Cc1cccc(CNc2cc(nc(n2)-c2ccc(cc2)S(C)(=O)=O)C(F)(F)F)c1 Show InChI InChI=1S/C20H18F3N3O2S/c1-13-4-3-5-14(10-13)12-24-18-11-17(20(21,22)23)25-19(26-18)15-6-8-16(9-7-15)29(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.18E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373603
(CHEMBL272587)Show SMILES Cc1cccc(CNc2cc(nc(n2)-c2ccc(cc2)S(C)(=O)=O)C(F)(F)F)c1 Show InChI InChI=1S/C20H18F3N3O2S/c1-13-4-3-5-14(10-13)12-24-18-11-17(20(21,22)23)25-19(26-18)15-6-8-16(9-7-15)29(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.18E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373601
(CHEMBL259469)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(cc2)C(F)(F)F)cc(n1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O2S/c1-32(30,31)15-8-4-13(5-9-15)18-28-16(20(24,25)26)10-17(29-18)27-11-12-2-6-14(7-3-12)19(21,22)23/h2-10H,11H2,1H3,(H,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373601
(CHEMBL259469)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(cc2)C(F)(F)F)cc(n1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O2S/c1-32(30,31)15-8-4-13(5-9-15)18-28-16(20(24,25)26)10-17(29-18)27-11-12-2-6-14(7-3-12)19(21,22)23/h2-10H,11H2,1H3,(H,27,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.21E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373535
(CHEMBL270111)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H22F3N3O2S/c1-28(26,27)15-9-7-14(8-10-15)18-24-16(19(20,21)22)11-17(25-18)23-12-13-5-3-2-4-6-13/h7-11,13H,2-6,12H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 6.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373535
(CHEMBL270111)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H22F3N3O2S/c1-28(26,27)15-9-7-14(8-10-15)18-24-16(19(20,21)22)11-17(25-18)23-12-13-5-3-2-4-6-13/h7-11,13H,2-6,12H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 6.76E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50486565
(CHEMBL2234865)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCCCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H18F3N3O2S2/c1-29(26,27)15-8-6-13(7-9-15)18-24-16(19(20,21)22)12-17(25-18)23-10-2-4-14-5-3-11-28-14/h3,5-9,11-12H,2,4,10H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
| n/a | n/a | 8.26E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50486565
(CHEMBL2234865)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCCCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H18F3N3O2S2/c1-29(26,27)15-8-6-13(7-9-15)18-24-16(19(20,21)22)12-17(25-18)23-10-2-4-14-5-3-11-28-14/h3,5-9,11-12H,2,4,10H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
| n/a | n/a | 8.26E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373536
(CHEMBL408897)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H21F3N4O2S/c19-18(20,21)15-10-16(23-11-12-4-2-1-3-5-12)25-17(24-15)13-6-8-14(9-7-13)28(22,26)27/h6-10,12H,1-5,11H2,(H2,22,26,27)(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.24E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373536
(CHEMBL408897)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H21F3N4O2S/c19-18(20,21)15-10-16(23-11-12-4-2-1-3-5-12)25-17(24-15)13-6-8-14(9-7-13)28(22,26)27/h6-10,12H,1-5,11H2,(H2,22,26,27)(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.24E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373531
(CHEMBL257483)Show SMILES CC(C)CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C16H18F3N3O2S/c1-10(2)9-20-14-8-13(16(17,18)19)21-15(22-14)11-4-6-12(7-5-11)25(3,23)24/h4-8,10H,9H2,1-3H3,(H,20,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.26E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373531
(CHEMBL257483)Show SMILES CC(C)CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C16H18F3N3O2S/c1-10(2)9-20-14-8-13(16(17,18)19)21-15(22-14)11-4-6-12(7-5-11)25(3,23)24/h4-8,10H,9H2,1-3H3,(H,20,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.27E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373532
(CHEMBL257491)Show SMILES CCCCCNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H20F3N3O2S/c1-3-4-5-10-21-15-11-14(17(18,19)20)22-16(23-15)12-6-8-13(9-7-12)26(2,24)25/h6-9,11H,3-5,10H2,1-2H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.37E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373532
(CHEMBL257491)Show SMILES CCCCCNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H20F3N3O2S/c1-3-4-5-10-21-15-11-14(17(18,19)20)22-16(23-15)12-6-8-13(9-7-12)26(2,24)25/h6-9,11H,3-5,10H2,1-2H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.37E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373598
(CHEMBL257300)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(O)cc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H16F3N3O3S/c1-29(27,28)15-8-4-13(5-9-15)18-24-16(19(20,21)22)10-17(25-18)23-11-12-2-6-14(26)7-3-12/h2-10,26H,11H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.57E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373598
(CHEMBL257300)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(O)cc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H16F3N3O3S/c1-29(27,28)15-8-4-13(5-9-15)18-24-16(19(20,21)22)10-17(25-18)23-11-12-2-6-14(26)7-3-12/h2-10,26H,11H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.57E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373596
(CHEMBL403099)Show SMILES Cc1ccsc1CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C18H16F3N3O2S2/c1-11-7-8-27-14(11)10-22-16-9-15(18(19,20)21)23-17(24-16)12-3-5-13(6-4-12)28(2,25)26/h3-9H,10H2,1-2H3,(H,22,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.89E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373610
(CHEMBL270723)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(SCc2ccccc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H15F3N2O2S2/c1-28(25,26)15-9-7-14(8-10-15)18-23-16(19(20,21)22)11-17(24-18)27-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.89E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373596
(CHEMBL403099)Show SMILES Cc1ccsc1CNc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C18H16F3N3O2S2/c1-11-7-8-27-14(11)10-22-16-9-15(18(19,20)21)23-17(24-16)12-3-5-13(6-4-12)28(2,25)26/h3-9H,10H2,1-2H3,(H,22,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.89E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373610
(CHEMBL270723)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(SCc2ccccc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H15F3N2O2S2/c1-28(25,26)15-9-7-14(8-10-15)18-23-16(19(20,21)22)11-17(24-18)27-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.89E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373612
(CHEMBL271312)Show SMILES CC(Nc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F)c1ccccc1 |w:1.0| Show InChI InChI=1S/C20H18F3N3O2S/c1-13(14-6-4-3-5-7-14)24-18-12-17(20(21,22)23)25-19(26-18)15-8-10-16(11-9-15)29(2,27)28/h3-13H,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.91E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373612
(CHEMBL271312)Show SMILES CC(Nc1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F)c1ccccc1 |w:1.0| Show InChI InChI=1S/C20H18F3N3O2S/c1-13(14-6-4-3-5-7-14)24-18-12-17(20(21,22)23)25-19(26-18)15-8-10-16(11-9-15)29(2,27)28/h3-13H,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.92E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373547
(CHEMBL257103)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NC2CCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H18F3N3O2S/c1-26(24,25)13-8-6-11(7-9-13)16-22-14(17(18,19)20)10-15(23-16)21-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373547
(CHEMBL257103)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NC2CCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H18F3N3O2S/c1-26(24,25)13-8-6-11(7-9-13)16-22-14(17(18,19)20)10-15(23-16)21-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373561
(CHEMBL403720)Show SMILES CN(Cc1ccccc1)c1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H18F3N3O2S/c1-26(13-14-6-4-3-5-7-14)18-12-17(20(21,22)23)24-19(25-18)15-8-10-16(11-9-15)29(2,27)28/h3-12H,13H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.20E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373561
(CHEMBL403720)Show SMILES CN(Cc1ccccc1)c1cc(nc(n1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F Show InChI InChI=1S/C20H18F3N3O2S/c1-26(13-14-6-4-3-5-7-14)18-12-17(20(21,22)23)24-19(25-18)15-8-10-16(11-9-15)29(2,27)28/h3-12H,13H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.20E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373602
(CHEMBL259678)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cc(F)cc(F)c2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H14F5N3O2S/c1-30(28,29)15-4-2-12(3-5-15)18-26-16(19(22,23)24)9-17(27-18)25-10-11-6-13(20)8-14(21)7-11/h2-9H,10H2,1H3,(H,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.33E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373602
(CHEMBL259678)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cc(F)cc(F)c2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H14F5N3O2S/c1-30(28,29)15-4-2-12(3-5-15)18-26-16(19(22,23)24)9-17(27-18)25-10-11-6-13(20)8-14(21)7-11/h2-9H,10H2,1H3,(H,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.33E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373541
(CHEMBL271763)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccncc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H15F3N4O2S/c1-28(26,27)14-4-2-13(3-5-14)17-24-15(18(19,20)21)10-16(25-17)23-11-12-6-8-22-9-7-12/h2-10H,11H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.35E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373541
(CHEMBL271763)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccncc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H15F3N4O2S/c1-28(26,27)14-4-2-13(3-5-14)17-24-15(18(19,20)21)10-16(25-17)23-11-12-6-8-22-9-7-12/h2-10H,11H2,1H3,(H,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.35E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373538
(CHEMBL273118)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cc3ccccc3s2)cc(n1)C(F)(F)F Show InChI InChI=1S/C21H16F3N3O2S2/c1-31(28,29)16-8-6-13(7-9-16)20-26-18(21(22,23)24)11-19(27-20)25-12-15-10-14-4-2-3-5-17(14)30-15/h2-11H,12H2,1H3,(H,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.40E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373538
(CHEMBL273118)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cc3ccccc3s2)cc(n1)C(F)(F)F Show InChI InChI=1S/C21H16F3N3O2S2/c1-31(28,29)16-8-6-13(7-9-16)20-26-18(21(22,23)24)11-19(27-20)25-12-15-10-14-4-2-3-5-17(14)30-15/h2-11H,12H2,1H3,(H,25,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.41E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373580
(CHEMBL272208)Show SMILES CC(C)Nc1cc(NCc2ccccc2)nc(n1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C21H24N4O2S/c1-15(2)23-20-13-19(22-14-16-7-5-4-6-8-16)24-21(25-20)17-9-11-18(12-10-17)28(3,26)27/h4-13,15H,14H2,1-3H3,(H2,22,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.65E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373580
(CHEMBL272208)Show SMILES CC(C)Nc1cc(NCc2ccccc2)nc(n1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C21H24N4O2S/c1-15(2)23-20-13-19(22-14-16-7-5-4-6-8-16)24-21(25-20)17-9-11-18(12-10-17)28(3,26)27/h4-13,15H,14H2,1-3H3,(H2,22,23,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.65E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373556
(CHEMBL414005)Show SMILES COc1ccc(CNc2cc(nc(n2)-c2ccc(cc2)S(C)(=O)=O)C(F)(F)F)cc1 Show InChI InChI=1S/C20H18F3N3O3S/c1-29-15-7-3-13(4-8-15)12-24-18-11-17(20(21,22)23)25-19(26-18)14-5-9-16(10-6-14)30(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.67E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373556
(CHEMBL414005)Show SMILES COc1ccc(CNc2cc(nc(n2)-c2ccc(cc2)S(C)(=O)=O)C(F)(F)F)cc1 Show InChI InChI=1S/C20H18F3N3O3S/c1-29-15-7-3-13(4-8-15)12-24-18-11-17(20(21,22)23)25-19(26-18)14-5-9-16(10-6-14)30(2,27)28/h3-11H,12H2,1-2H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.67E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373529
(CHEMBL257295)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H20F3N3O2S/c1-27(25,26)14-9-7-12(8-10-14)17-23-15(18(19,20)21)11-16(24-17)22-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,22,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.19E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373529
(CHEMBL257295)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NC2CCCCC2)cc(n1)C(F)(F)F Show InChI InChI=1S/C18H20F3N3O2S/c1-27(25,26)14-9-7-12(8-10-14)17-23-15(18(19,20)21)11-16(24-17)22-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,22,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.19E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373597
(CHEMBL403827)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(N)cc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H17F3N4O2S/c1-29(27,28)15-8-4-13(5-9-15)18-25-16(19(20,21)22)10-17(26-18)24-11-12-2-6-14(23)7-3-12/h2-10H,11,23H2,1H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.73E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373597
(CHEMBL403827)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2ccc(N)cc2)cc(n1)C(F)(F)F Show InChI InChI=1S/C19H17F3N4O2S/c1-29(27,28)15-8-4-13(5-9-15)18-25-16(19(20,21)22)10-17(26-18)24-11-12-2-6-14(23)7-3-12/h2-10H,11,23H2,1H3,(H,24,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.73E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373528
(CHEMBL271337)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C16H13F3N4O2S2/c17-16(18,19)13-8-14(21-9-11-2-1-7-26-11)23-15(22-13)10-3-5-12(6-4-10)27(20,24)25/h1-8H,9H2,(H2,20,24,25)(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 6.34E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373528
(CHEMBL271337)Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C16H13F3N4O2S2/c17-16(18,19)13-8-14(21-9-11-2-1-7-26-11)23-15(22-13)10-3-5-12(6-4-10)27(20,24)25/h1-8H,9H2,(H2,20,24,25)(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 6.35E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
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