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PubMed code 9599246

Compile data set for download or QSAR
Found 28 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408421
PNG
(CHEMBL2113725)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1c(F)c(F)cc(F)c1F)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H38F4N2O8S/c1-6-7-10-39(41)33(40)38-22-13-18(23-8-9-24(47-23)19-15-26(43-3)31(45-5)27(16-19)44-4)14-25(42-2)30(22)46-11-12-48-32-28(36)20(34)17-21(35)29(32)37/h13-17,23-24,41H,6-12H2,1-5H3,(H,38,40)/t23-,24-/m0/s1
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PubMed
n/an/a 2n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50002823
PNG
(2-{3-Methoxy-2-propoxy-5-[(2S,5S)-5-(3,4,5-trimeth...)
Show SMILES CCCOc1c(OC)cc(cc1S(=O)(=O)CCO)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C25H34O9S/c1-6-10-33-25-22(31-4)14-17(15-23(25)35(27,28)11-9-26)19-8-7-18(34-19)16-12-20(29-2)24(32-5)21(13-16)30-3/h12-15,18-19,26H,6-11H2,1-5H3/t18-,19-/m0/s1
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n/an/a 6n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408414
PNG
(CHEMBL2113720)
Show SMILES COc1cc(cc(CNC(=O)N(C)O)c1OCCSc1ccc(Cl)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C31H37ClN2O8S/c1-34(36)31(35)33-18-21-14-19(15-26(37-2)29(21)41-12-13-43-23-8-6-22(32)7-9-23)24-10-11-25(42-24)20-16-27(38-3)30(40-5)28(17-20)39-4/h6-9,14-17,24-25,36H,10-13,18H2,1-5H3,(H,33,35)/t24-,25-/m0/s1
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n/an/a 10n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408417
PNG
(CHEMBL2113724)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Cl)c(Cl)c1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H40Cl2N2O8S/c1-6-7-12-37(39)33(38)36-25-15-20(16-28(40-2)31(25)44-13-14-46-22-8-9-23(34)24(35)19-22)26-10-11-27(45-26)21-17-29(41-3)32(43-5)30(18-21)42-4/h8-9,15-19,26-27,39H,6-7,10-14H2,1-5H3,(H,36,38)/t26-,27-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408419
PNG
(CHEMBL2113723)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Br)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-14-36(38)33(37)35-25-17-21(18-28(39-2)31(25)43-15-16-45-24-10-8-23(34)9-11-24)26-12-13-27(44-26)22-19-29(40-3)32(42-5)30(20-22)41-4/h8-11,17-20,26-27,38H,6-7,12-16H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 19n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408413
PNG
(CHEMBL2113727)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Cl)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41ClN2O8S/c1-6-7-14-36(38)33(37)35-25-17-21(18-28(39-2)31(25)43-15-16-45-24-10-8-23(34)9-11-24)26-12-13-27(44-26)22-19-29(40-3)32(42-5)30(20-22)41-4/h8-11,17-20,26-27,38H,6-7,12-16H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408419
PNG
(CHEMBL2113723)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Br)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-14-36(38)33(37)35-25-17-21(18-28(39-2)31(25)43-15-16-45-24-10-8-23(34)9-11-24)26-12-13-27(44-26)22-19-29(40-3)32(42-5)30(20-22)41-4/h8-11,17-20,26-27,38H,6-7,12-16H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408418
PNG
(CHEMBL2113722)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1cccc(Br)c1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-13-36(38)33(37)35-25-16-21(17-28(39-2)31(25)43-14-15-45-24-10-8-9-23(34)20-24)26-11-12-27(44-26)22-18-29(40-3)32(42-5)30(19-22)41-4/h8-10,16-20,26-27,38H,6-7,11-15H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 22n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408422
PNG
(CHEMBL2113721)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccccc1Br)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-14-36(38)33(37)35-24-17-21(18-27(39-2)31(24)43-15-16-45-30-11-9-8-10-23(30)34)25-12-13-26(44-25)22-19-28(40-3)32(42-5)29(20-22)41-4/h8-11,17-20,25-26,38H,6-7,12-16H2,1-5H3,(H,35,37)/t25-,26-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408424
PNG
(CHEMBL2113733)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCS(=O)(=O)c1ccccc1Br)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O10S/c1-6-7-14-36(38)33(37)35-24-17-21(25-12-13-26(46-25)22-19-28(42-3)32(44-5)29(20-22)43-4)18-27(41-2)31(24)45-15-16-47(39,40)30-11-9-8-10-23(30)34/h8-11,17-20,25-26,38H,6-7,12-16H2,1-5H3,(H,35,37)/t25-,26-/m0/s1
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n/an/a 25n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50064506
PNG
(1-Butyl-3-{3-methoxy-2-propoxy-5-[5-(3,4,5-trimeth...)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCC)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C28H40N2O8/c1-7-9-12-30(32)28(31)29-20-14-18(15-23(33-3)26(20)37-13-8-2)21-10-11-22(38-21)19-16-24(34-4)27(36-6)25(17-19)35-5/h14-17,21-22,32H,7-13H2,1-6H3,(H,29,31)/t21-,22-/m0/s1
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n/an/a 33n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408422
PNG
(CHEMBL2113721)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccccc1Br)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-14-36(38)33(37)35-24-17-21(18-27(39-2)31(24)43-15-16-45-30-11-9-8-10-23(30)34)25-12-13-26(44-25)22-19-28(40-3)32(42-5)29(20-22)41-4/h8-11,17-20,25-26,38H,6-7,12-16H2,1-5H3,(H,35,37)/t25-,26-/m0/s1
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n/an/a 33n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408423
PNG
(CHEMBL2113726)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCS(=O)(=O)c1ccc(Br)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O10S/c1-6-7-14-36(38)33(37)35-25-17-21(26-12-13-27(46-26)22-19-29(42-3)32(44-5)30(20-22)43-4)18-28(41-2)31(25)45-15-16-47(39,40)24-10-8-23(34)9-11-24/h8-11,17-20,26-27,38H,6-7,12-16H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 38n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408415
PNG
(CHEMBL2113730)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(OC)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C34H44N2O9S/c1-7-8-15-36(38)34(37)35-26-18-22(19-29(40-3)32(26)44-16-17-46-25-11-9-24(39-2)10-12-25)27-13-14-28(45-27)23-20-30(41-4)33(43-6)31(21-23)42-5/h9-12,18-21,27-28,38H,7-8,13-17H2,1-6H3,(H,35,37)/t27-,28-/m0/s1
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n/an/a 39n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408418
PNG
(CHEMBL2113722)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1cccc(Br)c1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O8S/c1-6-7-13-36(38)33(37)35-25-16-21(17-28(39-2)31(25)43-14-15-45-24-10-8-9-23(34)20-24)26-11-12-27(44-26)22-18-29(40-3)32(42-5)30(19-22)41-4/h8-10,16-20,26-27,38H,6-7,11-15H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408417
PNG
(CHEMBL2113724)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Cl)c(Cl)c1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H40Cl2N2O8S/c1-6-7-12-37(39)33(38)36-25-15-20(16-28(40-2)31(25)44-13-14-46-22-8-9-23(34)24(35)19-22)26-10-11-27(45-26)21-17-29(41-3)32(43-5)30(18-21)42-4/h8-9,15-19,26-27,39H,6-7,10-14H2,1-5H3,(H,36,38)/t26-,27-/m0/s1
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n/an/a 45n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408413
PNG
(CHEMBL2113727)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(Cl)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41ClN2O8S/c1-6-7-14-36(38)33(37)35-25-17-21(18-28(39-2)31(25)43-15-16-45-24-10-8-23(34)9-11-24)26-12-13-27(44-26)22-19-29(40-3)32(42-5)30(20-22)41-4/h8-11,17-20,26-27,38H,6-7,12-16H2,1-5H3,(H,35,37)/t26-,27-/m0/s1
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n/an/a 58n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
5-lipoxygenase inhibitory activity determined by measuring the conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cell using thin-layer ...


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408415
PNG
(CHEMBL2113730)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1ccc(OC)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C34H44N2O9S/c1-7-8-15-36(38)34(37)35-26-18-22(19-29(40-3)32(26)44-16-17-46-25-11-9-24(39-2)10-12-25)27-13-14-28(45-27)23-20-30(41-4)33(43-6)31(21-23)42-5/h9-12,18-21,27-28,38H,7-8,13-17H2,1-6H3,(H,35,37)/t27-,28-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50000714
PNG
(3-[4-(2-Chloro-phenyl)-9-methyl-6H-1-thia-5,7,8,9a...)
Show SMILES Cc1nnc2CN=C(c3cc(CCC(=O)N4CCOCC4)sc3-n12)c1ccccc1Cl |c:6|
Show InChI InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3
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PubMed
n/an/a 94n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408414
PNG
(CHEMBL2113720)
Show SMILES COc1cc(cc(CNC(=O)N(C)O)c1OCCSc1ccc(Cl)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C31H37ClN2O8S/c1-34(36)31(35)33-18-21-14-19(15-26(37-2)29(21)41-12-13-43-23-8-6-22(32)7-9-23)24-10-11-25(42-24)20-16-27(38-3)30(40-5)28(17-20)39-4/h6-9,14-17,24-25,36H,10-13,18H2,1-5H3,(H,33,35)/t24-,25-/m0/s1
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n/an/a 100n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408421
PNG
(CHEMBL2113725)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCSc1c(F)c(F)cc(F)c1F)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H38F4N2O8S/c1-6-7-10-39(41)33(40)38-22-13-18(23-8-9-24(47-23)19-15-26(43-3)31(45-5)27(16-19)44-4)14-25(42-2)30(22)46-11-12-48-32-28(36)20(34)17-21(35)29(32)37/h13-17,23-24,41H,6-12H2,1-5H3,(H,38,40)/t23-,24-/m0/s1
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n/an/a 118n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408424
PNG
(CHEMBL2113733)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCS(=O)(=O)c1ccccc1Br)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H41BrN2O10S/c1-6-7-14-36(38)33(37)35-24-17-21(25-12-13-26(46-25)22-19-28(42-3)32(44-5)29(20-22)43-4)18-27(41-2)31(24)45-15-16-47(39,40)30-11-9-8-10-23(30)34/h8-11,17-20,25-26,38H,6-7,12-16H2,1-5H3,(H,35,37)/t25-,26-/m0/s1
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n/an/a 161n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408420
PNG
(CHEMBL2113731)
Show SMILES CCCCN(O)C(=O)NCc1cc(cc(OC)c1OCCSc1ccc(Cl)cc1)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C34H43ClN2O8S/c1-6-7-14-37(39)34(38)36-21-24-17-22(18-29(40-2)32(24)44-15-16-46-26-10-8-25(35)9-11-26)27-12-13-28(45-27)23-19-30(41-3)33(43-5)31(20-23)42-4/h8-11,17-20,27-28,39H,6-7,12-16,21H2,1-5H3,(H,36,38)/t27-,28-/m0/s1
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n/an/a 167n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Homo sapiens (Human))
BDBM50408416
PNG
(CHEMBL2113732)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCS(=O)(=O)c1c(F)c(F)cc(F)c1F)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H38F4N2O10S/c1-6-7-10-39(41)33(40)38-22-13-18(23-8-9-24(49-23)19-15-26(45-3)31(47-5)27(16-19)46-4)14-25(44-2)30(22)48-11-12-50(42,43)32-28(36)20(34)17-21(35)29(32)37/h13-17,23-24,41H,6-12H2,1-5H3,(H,38,40)/t23-,24-/m0/s1
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n/an/a 285n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Displacement of [3H]-PAF from PAF receptor of human platelet membranes


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50029775
PNG
((R)-(+)-N-{3-[5-(4-fluorophenoxy)furan-2-yl]-1-met...)
Show SMILES CC(C#Cc1ccc(Oc2ccc(F)cc2)o1)N(O)C(N)=O
Show InChI InChI=1S/C15H13FN2O4/c1-10(18(20)15(17)19)2-5-12-8-9-14(21-12)22-13-6-3-11(16)4-7-13/h3-4,6-10,20H,1H3,(H2,17,19)
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n/an/a 298n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50064506
PNG
(1-Butyl-3-{3-methoxy-2-propoxy-5-[5-(3,4,5-trimeth...)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCC)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C28H40N2O8/c1-7-9-12-30(32)28(31)29-20-14-18(15-23(33-3)26(20)37-13-8-2)21-10-11-22(38-21)19-16-24(34-4)27(36-6)25(17-19)35-5/h14-17,21-22,32H,7-13H2,1-6H3,(H,29,31)/t21-,22-/m0/s1
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n/an/a 424n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50408416
PNG
(CHEMBL2113732)
Show SMILES CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCS(=O)(=O)c1c(F)c(F)cc(F)c1F)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C33H38F4N2O10S/c1-6-7-10-39(41)33(40)38-22-13-18(23-8-9-24(49-23)19-15-26(45-3)31(47-5)27(16-19)46-4)14-25(44-2)30(22)48-11-12-50(42,43)32-28(36)20(34)17-21(35)29(32)37/h13-17,23-24,41H,6-12H2,1-5H3,(H,38,40)/t23-,24-/m0/s1
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n/an/a 520n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50000541
PNG
((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...)
Show SMILES CC(N(O)C(N)=O)c1cc2ccccc2s1
Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)
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PubMed
n/an/a 804n/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase mediated conversion of [14C]-arachidonic acid to leukotrienes in RBL-2H3 cells


J Med Chem 41: 1970-9 (1998)


Article DOI: 10.1021/jm980046r
BindingDB Entry DOI: 10.7270/Q2PV6JH2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%