Found 242 hits with Last Name = 'soca' and Initial = 'l' 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 |
|---|
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296089
(2-(2-(5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)ben...)Show SMILES OC(=O)c1ccccc1OCCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(F)cc3n2)c1 Show InChI InChI=1S/C38H31F2N3O3/c39-32-21-27-13-15-28(41-34(27)22-33(32)40)14-12-25-6-5-7-26(20-25)23-43-35-10-3-1-8-29(35)31-24-42(17-16-36(31)43)18-19-46-37-11-4-2-9-30(37)38(44)45/h1-15,20-22H,16-19,23-24H2,(H,44,45)/b14-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.910 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296106
(3-(5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(F)cc3n2)c1 Show InChI InChI=1S/C32H27F2N3O2/c33-27-17-23-9-11-24(35-29(23)18-28(27)34)10-8-21-4-3-5-22(16-21)19-37-30-7-2-1-6-25(30)26-20-36(14-12-31(26)37)15-13-32(38)39/h1-11,16-18H,12-15,19-20H2,(H,38,39)/b10-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296115
(3-(5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CCN1CCc2c(C1)c1c(F)cccc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(F)cc3n2)c1 Show InChI InChI=1S/C32H26F3N3O2/c33-25-5-2-6-30-32(25)24-19-37(14-12-31(39)40)13-11-29(24)38(30)18-21-4-1-3-20(15-21)7-9-23-10-8-22-16-26(34)27(35)17-28(22)36-23/h1-10,15-17H,11-14,18-19H2,(H,39,40)/b9-7+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296095
(2-(2-(1H-tetrazol-5-yl)ethyl)-9-(3-(2-(7-chloroqui...)Show SMILES Clc1ccc2ccc(C=Cc3cccc(Cn4c5CN(CCc6nnn[nH]6)CCc5c5ccccc45)c3)nc2c1 |w:9.9| Show InChI InChI=1S/C32H28ClN7/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-40-30-7-2-1-6-27(30)28-14-16-39(21-31(28)40)17-15-32-35-37-38-36-32/h1-13,18-19H,14-17,20-21H2,(H,35,36,37,38) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296092
(3-(5-(3-((7-chloroquinolin-2-yl)ethynyl)benzyl)-3,...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(c1)C#Cc1ccc2ccc(Cl)cc2n1 Show InChI InChI=1S/C32H26ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-7,9-11,13,18-19H,14-17,20-21H2,(H,37,38) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296105
(3-(5-(3-(2-(7-chloro-6-fluoroquinolin-2-yl)vinyl)b...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(Cl)cc3n2)c1 Show InChI InChI=1S/C32H27ClFN3O2/c33-27-18-29-23(17-28(27)34)9-11-24(35-29)10-8-21-4-3-5-22(16-21)19-37-30-7-2-1-6-25(30)26-20-36(14-12-31(26)37)15-13-32(38)39/h1-11,16-18H,12-15,19-20H2,(H,38,39)/b10-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296114
(3-(5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CCN1CCc2c(C1)c1cc(F)ccc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(F)cc3n2)c1 Show InChI InChI=1S/C32H26F3N3O2/c33-23-6-9-30-25(16-23)26-19-37(13-11-32(39)40)12-10-31(26)38(30)18-21-3-1-2-20(14-21)4-7-24-8-5-22-15-27(34)28(35)17-29(22)36-24/h1-9,14-17H,10-13,18-19H2,(H,39,40)/b7-4+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296088
(4-((5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)benzy...)Show SMILES OC(=O)c1ccc(CN2CCc3c(C2)c2ccccc2n3Cc2cccc(\C=C\c3ccc4cc(F)c(F)cc4n3)c2)cc1 Show InChI InChI=1S/C37H29F2N3O2/c38-32-19-28-13-15-29(40-34(28)20-33(32)39)14-10-24-4-3-5-26(18-24)22-42-35-7-2-1-6-30(35)31-23-41(17-16-36(31)42)21-25-8-11-27(12-9-25)37(43)44/h1-15,18-20H,16-17,21-23H2,(H,43,44)/b14-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296085
(2-(1-((5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CC1(CN2CCc3c(C2)c2ccccc2n3Cc2cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c2)CC1 Show InChI InChI=1S/C35H32ClN3O2/c36-27-11-9-26-10-13-28(37-31(26)19-27)12-8-24-4-3-5-25(18-24)21-39-32-7-2-1-6-29(32)30-22-38(17-14-33(30)39)23-35(15-16-35)20-34(40)41/h1-13,18-19H,14-17,20-23H2,(H,40,41)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296103
(3-(5-(3-(2-(7-fluoroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(F)cc3n2)c1 Show InChI InChI=1S/C32H28FN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-13,18-19H,14-17,20-21H2,(H,37,38)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296102
(4-(1-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-2-...)Show SMILES Cc1c(CCCC(O)=O)c2ccccc2n1Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C31H27ClN2O2/c1-21-27(9-5-11-31(35)36)28-8-2-3-10-30(28)34(21)20-23-7-4-6-22(18-23)12-16-26-17-14-24-13-15-25(32)19-29(24)33-26/h2-4,6-8,10,12-19H,5,9,11,20H2,1H3,(H,35,36)/b16-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296087
(4-(5-(3-((E)-2-(7-chloroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)\C=C\CN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C33H28ClN3O2/c34-26-13-11-25-12-15-27(35-30(25)20-26)14-10-23-5-3-6-24(19-23)21-37-31-8-2-1-7-28(31)29-22-36(18-16-32(29)37)17-4-9-33(38)39/h1-15,19-20H,16-18,21-22H2,(H,38,39)/b9-4+,14-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296101
(4-(1-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-1H...)Show SMILES OC(=O)CCCc1cn(Cc2cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c2)c2ccccc12 Show InChI InChI=1S/C30H25ClN2O2/c31-25-14-12-23-13-16-26(32-28(23)18-25)15-11-21-5-3-6-22(17-21)19-33-20-24(7-4-10-30(34)35)27-8-1-2-9-29(27)33/h1-3,5-6,8-9,11-18,20H,4,7,10,19H2,(H,34,35)/b15-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296113
(3-(5-(3-(2-(6,7-difluoroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccc(F)cc1n2Cc1cccc(\C=C\c2ccc3cc(F)c(F)cc3n2)c1 Show InChI InChI=1S/C32H26F3N3O2/c33-23-6-9-25-26-19-37(13-11-32(39)40)12-10-30(26)38(31(25)16-23)18-21-3-1-2-20(14-21)4-7-24-8-5-22-15-27(34)28(35)17-29(22)36-24/h1-9,14-17H,10-13,18-19H2,(H,39,40)/b7-4+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296099
(3-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-9H...)Show SMILES OC(=O)CCc1ccc2n(Cc3cccc(\C=C\c4ccc5ccc(Cl)cc5n4)c3)c3ccccc3c2c1 Show InChI InChI=1S/C33H25ClN2O2/c34-26-13-11-25-12-15-27(35-30(25)20-26)14-8-22-4-3-5-24(18-22)21-36-31-7-2-1-6-28(31)29-19-23(9-16-32(29)36)10-17-33(37)38/h1-9,11-16,18-20H,10,17,21H2,(H,37,38)/b14-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296100
(2-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-2,...)Show SMILES OC(=O)CC1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C32H27ClN2O2/c33-25-12-10-24-11-14-26(34-29(24)19-25)13-8-21-4-3-5-23(16-21)20-35-30-7-2-1-6-27(30)28-17-22(18-32(36)37)9-15-31(28)35/h1-8,10-14,16,19,22H,9,15,17-18,20H2,(H,36,37)/b13-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296112
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-8-...)Show SMILES COc1ccc2n(Cc3cccc(\C=C\c4ccc5ccc(Cl)cc5n4)c3)c3CCN(CCC(O)=O)Cc3c2c1 Show InChI InChI=1S/C33H30ClN3O3/c1-40-27-11-12-31-28(19-27)29-21-36(16-14-33(38)39)15-13-32(29)37(31)20-23-4-2-3-22(17-23)5-9-26-10-7-24-6-8-25(34)18-30(24)35-26/h2-12,17-19H,13-16,20-21H2,1H3,(H,38,39)/b9-5+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296097
(3-((2-(1-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl...)Show SMILES CN(CCC(O)=O)CCc1cn(Cc2cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c2)c2ccccc12 Show InChI InChI=1S/C32H30ClN3O2/c1-35(18-16-32(37)38)17-15-26-22-36(31-8-3-2-7-29(26)31)21-24-6-4-5-23(19-24)9-13-28-14-11-25-10-12-27(33)20-30(25)34-28/h2-14,19-20,22H,15-18,21H2,1H3,(H,37,38)/b13-9+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296096
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CCN1CCC2C(C1)c1ccccc1N2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C32H30ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-13,18-19,28,31H,14-17,20-21H2,(H,37,38)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296116
(3-(5-((2-(7-chloroquinolin-2-yl)benzofuran-5-yl)me...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1ccc2oc(cc2c1)-c1ccc2ccc(Cl)cc2n1 Show InChI InChI=1S/C32H26ClN3O3/c33-23-8-6-21-7-9-26(34-27(21)17-23)31-16-22-15-20(5-10-30(22)39-31)18-36-28-4-2-1-3-24(28)25-19-35(13-11-29(25)36)14-12-32(37)38/h1-10,15-17H,11-14,18-19H2,(H,37,38) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296094
(4-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-4,...)Show SMILES OC(=O)CCCN1CCC2C(C1)N(Cc1cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c1)c1ccccc21 Show InChI InChI=1S/C33H32ClN3O2/c34-26-13-11-25-12-15-27(35-30(25)20-26)14-10-23-5-3-6-24(19-23)21-37-31-8-2-1-7-28(31)29-16-18-36(22-32(29)37)17-4-9-33(38)39/h1-3,5-8,10-15,19-20,29,32H,4,9,16-18,21-22H2,(H,38,39)/b14-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296081
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C32H28ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-13,18-19H,14-17,20-21H2,(H,37,38)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296111
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-7-...)Show SMILES COc1ccc2c3CN(CCC(O)=O)CCc3n(Cc3cccc(\C=C\c4ccc5ccc(Cl)cc5n4)c3)c2c1 Show InChI InChI=1S/C33H30ClN3O3/c1-40-27-11-12-28-29-21-36(16-14-33(38)39)15-13-31(29)37(32(28)19-27)20-23-4-2-3-22(17-23)5-9-26-10-7-24-6-8-25(34)18-30(24)35-26/h2-12,17-19H,13-16,20-21H2,1H3,(H,38,39)/b9-5+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296084
(5-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CCCCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C34H32ClN3O2/c35-27-14-12-26-13-16-28(36-31(26)21-27)15-11-24-6-5-7-25(20-24)22-38-32-9-2-1-8-29(32)30-23-37(19-17-33(30)38)18-4-3-10-34(39)40/h1-2,5-9,11-16,20-21H,3-4,10,17-19,22-23H2,(H,39,40)/b15-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296082
(2-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C31H26ClN3O2/c32-24-11-9-23-10-13-25(33-28(23)17-24)12-8-21-4-3-5-22(16-21)18-35-29-7-2-1-6-26(29)27-19-34(20-31(36)37)15-14-30(27)35/h1-13,16-17H,14-15,18-20H2,(H,36,37)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296093
(3-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-4,...)Show SMILES OC(=O)CCN1CCC2C(C1)N(Cc1cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c1)c1ccccc21 Show InChI InChI=1S/C32H30ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-14-16-35(21-31(28)36)17-15-32(37)38/h1-13,18-19,28,31H,14-17,20-21H2,(H,37,38)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296104
(3-(5-(3-(2-(6,7-dichloroquinolin-2-yl)vinyl)benzyl...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3cc(Cl)c(Cl)cc3n2)c1 Show InChI InChI=1S/C32H27Cl2N3O2/c33-27-17-23-9-11-24(35-29(23)18-28(27)34)10-8-21-4-3-5-22(16-21)19-37-30-7-2-1-6-25(30)26-20-36(14-12-31(26)37)15-13-32(38)39/h1-11,16-18H,12-15,19-20H2,(H,38,39)/b10-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296091
(3-(5-(3-(2-(7-chloroquinolin-2-yl)ethyl)benzyl)-3,...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(CCc2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C32H30ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-7,9-11,13,18-19H,8,12,14-17,20-21H2,(H,37,38) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296086
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CC(=O)N1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C32H26ClN3O3/c33-24-11-9-23-10-13-25(34-28(23)17-24)12-8-21-4-3-5-22(16-21)19-36-29-7-2-1-6-26(29)27-20-35(15-14-30(27)36)31(37)18-32(38)39/h1-13,16-17H,14-15,18-20H2,(H,38,39)/b12-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296083
(4-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-3,...)Show SMILES OC(=O)CCCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C33H30ClN3O2/c34-26-13-11-25-12-15-27(35-30(25)20-26)14-10-23-5-3-6-24(19-23)21-37-31-8-2-1-7-28(31)29-22-36(18-16-32(29)37)17-4-9-33(38)39/h1-3,5-8,10-15,19-20H,4,9,16-18,21-22H2,(H,38,39)/b14-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296107
(3-(5-(3-(2-(4-tert-butylthiazol-2-yl)vinyl)benzyl)...)Show SMILES CC(C)(C)c1csc(\C=C\c2cccc(Cn3c4CCN(CCC(O)=O)Cc4c4ccccc34)c2)n1 Show InChI InChI=1S/C30H33N3O2S/c1-30(2,3)27-20-36-28(31-27)12-11-21-7-6-8-22(17-21)18-33-25-10-5-4-9-23(25)24-19-32(15-13-26(24)33)16-14-29(34)35/h4-12,17,20H,13-16,18-19H2,1-3H3,(H,34,35)/b12-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296090
(3-(5-(3-((7-chloroquinolin-2-yl)methoxy)benzyl)-3,...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(OCc2ccc3ccc(Cl)cc3n2)c1 Show InChI InChI=1S/C31H28ClN3O3/c32-23-10-8-22-9-11-24(33-28(22)17-23)20-38-25-5-3-4-21(16-25)18-35-29-7-2-1-6-26(29)27-19-34(14-12-30(27)35)15-13-31(36)37/h1-11,16-17H,12-15,18-20H2,(H,36,37) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296109
(3-(5-(3-(2-(2,3-dichlorothieno[3,2-b]pyridin-5-yl)...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3sc(Cl)c(Cl)c3n2)c1 Show InChI InChI=1S/C30H25Cl2N3O2S/c31-28-29-26(38-30(28)32)11-10-21(33-29)9-8-19-4-3-5-20(16-19)17-35-24-7-2-1-6-22(24)23-18-34(14-12-25(23)35)15-13-27(36)37/h1-11,16H,12-15,17-18H2,(H,36,37)/b9-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150210
(3-(2-Fluoro-4-methyl-phenoxy)-2-(4-methanesulfonyl...)Show SMILES Cc1ccc(Oc2c(oc(C)cc2=O)-c2ccc(cc2)S(C)(=O)=O)c(F)c1 Show InChI InChI=1S/C20H17FO5S/c1-12-4-9-18(16(21)10-12)26-20-17(22)11-13(2)25-19(20)14-5-7-15(8-6-14)27(3,23)24/h4-11H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296098
(3-(((1-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-...)Show SMILES CN(CCC(O)=O)Cc1cn(Cc2cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c2)c2ccccc12 Show InChI InChI=1S/C31H28ClN3O2/c1-34(16-15-31(36)37)20-25-21-35(30-8-3-2-7-28(25)30)19-23-6-4-5-22(17-23)9-13-27-14-11-24-10-12-26(32)18-29(24)33-27/h2-14,17-18,21H,15-16,19-20H2,1H3,(H,36,37)/b13-9+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 61 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150211
(3-(2,4-Difluoro-phenoxy)-2-(4-methanesulfonyl-phen...)Show SMILES Cc1cc(=O)c(Oc2ccc(F)cc2F)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C19H14F2O5S/c1-11-9-16(22)19(26-17-8-5-13(20)10-15(17)21)18(25-11)12-3-6-14(7-4-12)27(2,23)24/h3-10H,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
| Article
PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296108
(3-(5-(3-(2-(5-chlorobenzo[d]thiazol-2-yl)vinyl)ben...)Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2nc3cc(Cl)ccc3s2)c1 Show InChI InChI=1S/C30H26ClN3O2S/c31-22-9-10-28-25(17-22)32-29(37-28)11-8-20-4-3-5-21(16-20)18-34-26-7-2-1-6-23(26)24-19-33(14-12-27(24)34)15-13-30(35)36/h1-11,16-17H,12-15,18-19H2,(H,35,36)/b11-8+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 112 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Cysteinyl leukotriene receptor 1
(GUINEA PIG) | BDBM50296110
(3-(5-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-6-...)Show SMILES CCOc1cccc2c3CN(CCC(O)=O)CCc3n(Cc3cccc(\C=C\c4ccc5ccc(Cl)cc5n4)c3)c12 Show InChI InChI=1S/C34H32ClN3O3/c1-2-41-32-8-4-7-28-29-22-37(18-16-33(39)40)17-15-31(29)38(34(28)32)21-24-6-3-5-23(19-24)9-13-27-14-11-25-10-12-26(35)20-30(25)36-27/h3-14,19-20H,2,15-18,21-22H2,1H3,(H,39,40)/b13-9+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat de Barcelona
Curated by ChEMBL
| Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane |
Bioorg Med Chem Lett 19: 4299-302 (2009)
Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1 |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150226
(3-(4-Bromo-2-fluoro-phenoxy)-2-(4-methanesulfonyl-...)Show SMILES Cc1cc(=O)c(Oc2ccc(Br)cc2F)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C19H14BrFO5S/c1-11-9-16(22)19(26-17-8-5-13(20)10-15(17)21)18(25-11)12-3-6-14(7-4-12)27(2,23)24/h3-10H,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
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150202
(2-(4-Methanesulfonyl-phenyl)-6-methyl-3-o-tolyloxy...)Show SMILES Cc1cc(=O)c(Oc2ccccc2C)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H18O5S/c1-13-6-4-5-7-18(13)25-20-17(21)12-14(2)24-19(20)15-8-10-16(11-9-15)26(3,22)23/h4-12H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150193
(3-(2-Chloro-4-methoxy-phenoxy)-2-(4-methanesulfony...)Show SMILES COc1ccc(Oc2c(oc(C)cc2=O)-c2ccc(cc2)S(C)(=O)=O)c(Cl)c1 Show InChI InChI=1S/C20H17ClO6S/c1-12-10-17(22)20(27-18-9-6-14(25-2)11-16(18)21)19(26-12)13-4-7-15(8-5-13)28(3,23)24/h4-11H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150215
(3-(4-Fluoro-2-methyl-phenoxy)-2-(4-methanesulfonyl...)Show SMILES Cc1cc(=O)c(Oc2ccc(F)cc2C)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H17FO5S/c1-12-10-15(21)6-9-18(12)26-20-17(22)11-13(2)25-19(20)14-4-7-16(8-5-14)27(3,23)24/h4-11H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150197
(3-(4-Chloro-2-methyl-phenoxy)-2-(4-methanesulfonyl...)Show SMILES Cc1cc(=O)c(Oc2ccc(Cl)cc2C)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H17ClO5S/c1-12-10-15(21)6-9-18(12)26-20-17(22)11-13(2)25-19(20)14-4-7-16(8-5-14)27(3,23)24/h4-11H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(RAT) | 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
UniProtKB/SwissProt
B.MOAD
GoogleScholar
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| Purchase
CHEMBL
DrugBank
MCE
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MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against rat prostaglandin G/H synthase 1 |
Bioorg Med Chem Lett 11: 2687-90 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XV1 |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150185
(3-(4-Chloro-2-fluoro-phenoxy)-2-(4-methanesulfonyl...)Show SMILES Cc1cc(=O)c(Oc2ccc(Cl)cc2F)c(o1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C19H14ClFO5S/c1-11-9-16(22)19(26-17-8-5-13(20)10-15(17)21)18(25-11)12-3-6-14(7-4-12)27(2,23)24/h3-10H,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
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50150224
(2-(4-Methanesulfonyl-phenyl)-6-methyl-3-p-tolyloxy...)Show SMILES Cc1ccc(Oc2c(oc(C)cc2=O)-c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C20H18O5S/c1-13-4-8-16(9-5-13)25-20-18(21)12-14(2)24-19(20)15-6-10-17(11-7-15)26(3,22)23/h4-12H,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
| Article
PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood |
J Med Chem 47: 3874-86 (2004)
Article DOI: 10.1021/jm049882t
BindingDB Entry DOI: 10.7270/Q2HM57WX |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50084355
(4-[3-(4-Methoxy-phenyl)-2-oxo-2,3-dihydro-oxazol-4...)Show SMILES COc1ccc(cc1)-n1c(coc1=O)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H14N2O5S/c1-22-13-6-4-12(5-7-13)18-15(10-23-16(18)19)11-2-8-14(9-3-11)24(17,20)21/h2-10H,1H3,(H2,17,20,21) | 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 | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibitory activity against prostaglandin G/H synthase 2 |
J Med Chem 43: 214-23 (2000)
BindingDB Entry DOI: 10.7270/Q2DV1KK0 |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(RAT) | BDBM50105290
(2-[7-Methoxy-4-(4-methyl-benzyl)-naphthalen-1-yl]-...)Show InChI InChI=1S/C22H22O3/c1-14-4-6-16(7-5-14)12-17-8-10-19(15(2)22(23)24)21-13-18(25-3)9-11-20(17)21/h4-11,13,15H,12H2,1-3H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against rat Prostaglandin G/H synthase 2 |
Bioorg Med Chem Lett 11: 2687-90 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XV1 |
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 | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
Inhibitory activity against prostaglandin G/H synthase 2 |
J Med Chem 43: 214-23 (2000)
BindingDB Entry DOI: 10.7270/Q2DV1KK0 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Prostaglandin G/H synthase 2
(RAT) | 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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Rhône-Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against rat Prostaglandin G/H synthase 2 |
Bioorg Med Chem Lett 11: 2687-90 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XV1 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
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