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Compile Data Set for Download or QSAR

Found 99 hits with Last Name = 'léger' and Initial = 's'   
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
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280701
PNG
(CHEMBL275357 | Sodium; (R)-3-{(R)-1-[3-(7-chloro-q...)
Show SMILES C[C@@H](CS[C@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m0/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280701
PNG
(CHEMBL275357 | Sodium; (R)-3-{(R)-1-[3-(7-chloro-q...)
Show SMILES C[C@@H](CS[C@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m0/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280712
PNG
(CHEMBL14819 | Sodium; 3-{1-[3-(7-chloro-quinolin-2...)
Show SMILES [O-]C(=O)CCSC(CCc1ccccc1-c1nnc[nH]1)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C30H27ClN4O3S/c31-23-11-8-21-9-12-24(34-27(21)17-23)18-38-25-6-3-5-22(16-25)28(39-15-14-29(36)37)13-10-20-4-1-2-7-26(20)30-32-19-33-35-30/h1-9,11-12,16-17,19,28H,10,13-15,18H2,(H,36,37)(H,32,33,35)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280693
PNG
(CHEMBL15370 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CC(CSC(CCc1ccccc1[N+]([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C29H27ClN2O5S/c1-19(29(33)34)18-38-28(14-11-21-5-2-3-8-27(21)32(35)36)22-6-4-7-25(15-22)37-17-24-13-10-20-9-12-23(30)16-26(20)31-24/h2-10,12-13,15-16,19,28H,11,14,17-18H2,1H3,(H,33,34)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280713
PNG
(CHEMBL15232 | Sodium; 2-{1-[3-(7-chloro-quinolin-2...)
Show SMILES CCC(CSC(CCc1ccccc1-c1nnnn1C)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H32ClN5O3S/c1-3-21(32(39)40)20-42-30(16-13-22-7-4-5-10-28(22)31-35-36-37-38(31)2)24-8-6-9-27(17-24)41-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30H,3,13,16,19-20H2,1-2H3,(H,39,40)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280687
PNG
(CHEMBL280310 | Sodium; 2-[1-[3-(7-chloro-quinolin-...)
Show SMILES CCNC(=O)c1ccccc1CCC(SCC(CC)C([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C33H35ClN2O4S/c1-3-22(33(38)39)21-41-31(17-14-23-8-5-6-11-29(23)32(37)35-4-2)25-9-7-10-28(18-25)40-20-27-16-13-24-12-15-26(34)19-30(24)36-27/h5-13,15-16,18-19,22,31H,3-4,14,17,20-21H2,1-2H3,(H,35,37)(H,38,39)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280686
PNG
(CHEMBL15120 | Sodium; 2-{3-(2-carbamoyl-phenyl)-1-...)
Show SMILES CCC(CSC(CCc1ccccc1C(N)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H31ClN2O4S/c1-2-20(31(36)37)19-39-29(15-12-21-6-3-4-9-27(21)30(33)35)23-7-5-8-26(16-23)38-18-25-14-11-22-10-13-24(32)17-28(22)34-25/h3-11,13-14,16-17,20,29H,2,12,15,18-19H2,1H3,(H2,33,35)(H,36,37)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280693
PNG
(CHEMBL15370 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CC(CSC(CCc1ccccc1[N+]([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C29H27ClN2O5S/c1-19(29(33)34)18-38-28(14-11-21-5-2-3-8-27(21)32(35)36)22-6-4-7-25(15-22)37-17-24-13-10-20-9-12-23(30)16-26(20)31-24/h2-10,12-13,15-16,19,28H,11,14,17-18H2,1H3,(H,33,34)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280696
PNG
(CHEMBL274913 | Sodium; (S)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280695
PNG
(CHEMBL279630 | Sodium; 2-[1-{3-[2-(7-chloro-quinol...)
Show SMILES CCOC(=O)Nc1ccccc1CCC(SCC(CC)C([O-])=O)c1cccc(CCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C34H37ClN2O4S/c1-3-24(33(38)39)22-42-32(19-15-25-9-5-6-11-30(25)37-34(40)41-4-2)27-10-7-8-23(20-27)12-17-29-18-14-26-13-16-28(35)21-31(26)36-29/h5-11,13-14,16,18,20-21,24,32H,3-4,12,15,17,19,22H2,1-2H3,(H,37,40)(H,38,39)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280699
PNG
(3-[1-[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-3-...)
Show SMILES CC(CSC(CCc1ccccc1C(=O)N(C)C)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C(O)=O
Show InChI InChI=1S/C32H33ClN2O4S/c1-21(32(37)38)20-40-30(16-13-22-7-4-5-10-28(22)31(36)35(2)3)24-8-6-9-27(17-24)39-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30H,13,16,19-20H2,1-3H3,(H,37,38)
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280698
PNG
(CHEMBL274049 | Sodium; 3-[1-[3-(7-chloro-quinolin-...)
Show SMILES CS(=O)(=O)Nc1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C29H29ClN2O5S2/c1-39(35,36)32-26-8-3-2-5-20(26)11-14-28(38-16-15-29(33)34)22-6-4-7-25(17-22)37-19-24-13-10-21-9-12-23(30)18-27(21)31-24/h2-10,12-13,17-18,28,32H,11,14-16,19H2,1H3,(H,33,34)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280689
PNG
(CHEMBL278411 | Sodium; 3-{1-[3-(7-chloro-quinolin-...)
Show SMILES [O-]C(=O)CCSC(CCc1ccccc1C(=O)N1CCCCC1)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C34H35ClN2O4S/c35-27-14-11-25-12-15-28(36-31(25)22-27)23-41-29-9-6-8-26(21-29)32(42-20-17-33(38)39)16-13-24-7-2-3-10-30(24)34(40)37-18-4-1-5-19-37/h2-3,6-12,14-15,21-22,32H,1,4-5,13,16-20,23H2,(H,38,39)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280695
PNG
(CHEMBL279630 | Sodium; 2-[1-{3-[2-(7-chloro-quinol...)
Show SMILES CCOC(=O)Nc1ccccc1CCC(SCC(CC)C([O-])=O)c1cccc(CCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C34H37ClN2O4S/c1-3-24(33(38)39)22-42-32(19-15-25-9-5-6-11-30(25)37-34(40)41-4-2)27-10-7-8-23(20-27)12-17-29-18-14-26-13-16-28(35)21-31(26)36-29/h5-11,13-14,16,18,20-21,24,32H,3-4,12,15,17,19,22H2,1-2H3,(H,37,40)(H,38,39)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280698
PNG
(CHEMBL274049 | Sodium; 3-[1-[3-(7-chloro-quinolin-...)
Show SMILES CS(=O)(=O)Nc1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C29H29ClN2O5S2/c1-39(35,36)32-26-8-3-2-5-20(26)11-14-28(38-16-15-29(33)34)22-6-4-7-25(17-22)37-19-24-13-10-21-9-12-23(30)18-27(21)31-24/h2-10,12-13,17-18,28,32H,11,14-16,19H2,1H3,(H,33,34)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280709
PNG
(CHEMBL15344 | Sodium; 2-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CCC(CSC(CCc1ccccc1S(C)(=O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H32ClNO5S2/c1-3-21(31(34)35)20-39-29(16-13-23-7-4-5-10-30(23)40(2,36)37)24-8-6-9-27(17-24)38-19-26-15-12-22-11-14-25(32)18-28(22)33-26/h4-12,14-15,17-18,21,29H,3,13,16,19-20H2,1-2H3,(H,34,35)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280694
PNG
(CHEMBL15292 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES NS(=O)(=O)c1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C28H27ClN2O5S2/c29-22-11-8-19-9-12-23(31-25(19)17-22)18-36-24-6-3-5-21(16-24)26(37-15-14-28(32)33)13-10-20-4-1-2-7-27(20)38(30,34)35/h1-9,11-12,16-17,26H,10,13-15,18H2,(H,32,33)(H2,30,34,35)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280694
PNG
(CHEMBL15292 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES NS(=O)(=O)c1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C28H27ClN2O5S2/c29-22-11-8-19-9-12-23(31-25(19)17-22)18-36-24-6-3-5-21(16-24)26(37-15-14-28(32)33)13-10-20-4-1-2-7-27(20)38(30,34)35/h1-9,11-12,16-17,26H,10,13-15,18H2,(H,32,33)(H2,30,34,35)/p-1
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n/an/a 0.600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280709
PNG
(CHEMBL15344 | Sodium; 2-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CCC(CSC(CCc1ccccc1S(C)(=O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H32ClNO5S2/c1-3-21(31(34)35)20-39-29(16-13-23-7-4-5-10-30(23)40(2,36)37)24-8-6-9-27(17-24)38-19-26-15-12-22-11-14-25(32)18-28(22)33-26/h4-12,14-15,17-18,21,29H,3,13,16,19-20H2,1-2H3,(H,34,35)/p-1
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n/an/a 0.600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Leukotriene D4 induced contraction of guinea-pig trachea was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280703
PNG
(CHEMBL278210 | Sodium; 2-{1-[3-(7-chloro-quinolin-...)
Show SMILES CCC(CSC(CCc1ccccc1-c1nnn[nH]1)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H30ClN5O3S/c1-2-20(31(38)39)19-41-29(15-12-21-6-3-4-9-27(21)30-34-36-37-35-30)23-7-5-8-26(16-23)40-18-25-14-11-22-10-13-24(32)17-28(22)33-25/h3-11,13-14,16-17,20,29H,2,12,15,18-19H2,1H3,(H,38,39)(H,34,35,36,37)/p-1
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n/an/a 0.800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280696
PNG
(CHEMBL274913 | Sodium; (S)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m1/s1
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n/an/a 0.850n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280714
PNG
((S)-2-{(S)-1-{3-[(E)-2-(7-Chloro-quinolin-2-yl)-vi...)
Show SMILES CCC[C@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1)C(O)=O
Show InChI InChI=1S/C35H38ClNO3S/c1-4-8-28(34(38)39)23-41-33(20-16-25-10-5-6-12-31(25)35(2,3)40)27-11-7-9-24(21-27)13-18-30-19-15-26-14-17-29(36)22-32(26)37-30/h5-7,9-15,17-19,21-22,28,33,40H,4,8,16,20,23H2,1-3H3,(H,38,39)/b18-13+/t28-,33+/m1/s1
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n/an/a 0.900n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280715
PNG
(CHEMBL15513 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CN(C)C(=O)c1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C31H31ClN2O4S/c1-34(2)31(37)27-9-4-3-6-21(27)12-15-29(39-17-16-30(35)36)23-7-5-8-26(18-23)38-20-25-14-11-22-10-13-24(32)19-28(22)33-25/h3-11,13-14,18-19,29H,12,15-17,20H2,1-2H3,(H,35,36)/p-1
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n/an/a 0.950n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280702
PNG
(3-[1-[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-3-...)
Show SMILES CN(C)C(=O)c1ccccc1CCC(SCCC(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C31H31ClN2O4S/c1-34(2)31(37)27-9-4-3-6-21(27)12-15-29(39-17-16-30(35)36)23-7-5-8-26(18-23)38-20-25-14-11-22-10-13-24(32)19-28(22)33-25/h3-11,13-14,18-19,29H,12,15-17,20H2,1-2H3,(H,35,36)
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n/an/a 0.950n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280708
PNG
(CHEMBL416161 | Sodium; 2-[1-{3-[2-(7-chloro-quinol...)
Show SMILES CCC(CSC(CCc1ccccc1C#N)c1cccc(CCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H31ClN2O2S/c1-2-23(32(36)37)21-38-31(17-13-24-7-3-4-8-27(24)20-34)26-9-5-6-22(18-26)10-15-29-16-12-25-11-14-28(33)19-30(25)35-29/h3-9,11-12,14,16,18-19,23,31H,2,10,13,15,17,21H2,1H3,(H,36,37)/p-1
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n/an/a 1n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280707
PNG
(3-(1-{3-[(E)-2-(7-Chloro-quinolin-2-yl)-vinyl]-phe...)
Show SMILES CC(CCC(SCCC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1)CC(=O)N(C)C
Show InChI InChI=1S/C29H33ClN2O3S/c1-20(17-28(33)32(2)3)7-14-27(36-16-15-29(34)35)23-6-4-5-21(18-23)8-12-25-13-10-22-9-11-24(30)19-26(22)31-25/h4-6,8-13,18-20,27H,7,14-17H2,1-3H3,(H,34,35)/b12-8+
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n/an/a 1.30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280688
PNG
(CHEMBL429975 | Sodium; 2-{1-[3-(7-chloro-quinolin-...)
Show SMILES CCC(CSC(CCc1ccccc1C(=O)NS(=O)(=O)c1ccccc1C)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C38H37ClN2O6S2/c1-3-26(38(43)44)24-48-35(29-11-8-12-32(21-29)47-23-31-19-16-28-15-18-30(39)22-34(28)40-31)20-17-27-10-5-6-13-33(27)37(42)41-49(45,46)36-14-7-4-9-25(36)2/h4-16,18-19,21-22,26,35H,3,17,20,23-24H2,1-2H3,(H,41,42)(H,43,44)/p-1
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n/an/a 1.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280710
PNG
(2-[3-[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-3-...)
Show SMILES CN(C)C(=O)CCSC(CCc1ccccc1C(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C31H31ClN2O4S/c1-34(2)30(35)16-17-39-29(15-12-21-6-3-4-9-27(21)31(36)37)23-7-5-8-26(18-23)38-20-25-14-11-22-10-13-24(32)19-28(22)33-25/h3-11,13-14,18-19,29H,12,15-17,20H2,1-2H3,(H,36,37)
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n/an/a 1.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280697
PNG
(CHEMBL280260 | Sodium; 2-{3-(2-carboxy-phenyl)-1-[...)
Show SMILES CCC(CSC(CCc1ccccc1C(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H30ClNO5S/c1-2-20(30(34)35)19-39-29(15-12-21-6-3-4-9-27(21)31(36)37)23-7-5-8-26(16-23)38-18-25-14-11-22-10-13-24(32)17-28(22)33-25/h3-11,13-14,16-17,20,29H,2,12,15,18-19H2,1H3,(H,34,35)(H,36,37)/p-1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))		BDBM50029559
PNG
(2-[3-tert-Butylsulfanyl-1-(4-chloro-benzyl)-5-(qui...)
Show SMILES CC(C)(C)Sc1c(CC(C)(C)C(O)=O)n(Cc2ccc(Cl)cc2)c2ccc(OCc3ccc4ccccc4n3)cc12
Show InChI InChI=1S/C34H35ClN2O3S/c1-33(2,3)41-31-27-18-26(40-21-25-15-12-23-8-6-7-9-28(23)36-25)16-17-29(27)37(20-22-10-13-24(35)14-11-22)30(31)19-34(4,5)32(38)39/h6-18H,19-21H2,1-5H3,(H,38,39)
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was tested for the inhibition of binding of [125I]- L- 691,831 binding to 5-lipoxygenase activating protein

Bioorg Med Chem Lett 2: 1395-1398 (1992)


Article DOI: 10.1016/S0960-894X(00)80520-X
BindingDB Entry DOI: 10.7270/Q2028RGQ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280697
PNG
(CHEMBL280260 | Sodium; 2-{3-(2-carboxy-phenyl)-1-[...)
Show SMILES CCC(CSC(CCc1ccccc1C(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C31H30ClNO5S/c1-2-20(30(34)35)19-39-29(15-12-21-6-3-4-9-27(21)31(36)37)23-7-5-8-26(16-23)38-18-25-14-11-22-10-13-24(32)17-28(22)33-25/h3-11,13-14,16-17,20,29H,2,12,15,18-19H2,1H3,(H,34,35)(H,36,37)/p-1
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined (Experiment 2)

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280705
PNG
(CHEMBL15306 | Sodium; (S)-3-{(R)-1-[3-(7-chloro-qu...)
Show SMILES C[C@H](CS[C@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280691
PNG
(3-{1-[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-3-...)
Show SMILES CC(CSC(CCc1ccccc1C(=O)N(C)CO)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C(O)=O
Show InChI InChI=1S/C32H33ClN2O5S/c1-21(32(38)39)19-41-30(15-12-22-6-3-4-9-28(22)31(37)35(2)20-36)24-7-5-8-27(16-24)40-18-26-14-11-23-10-13-25(33)17-29(23)34-26/h3-11,13-14,16-17,21,30,36H,12,15,18-20H2,1-2H3,(H,38,39)
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n/an/a 3.60n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50001285
PNG
((E)-3-((3-(2-(7-chloroquinolin-2-yl)vinyl)phenyl)(...)
Show SMILES CN(C)C(=O)CCSC(SCCC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C26H27ClN2O3S2/c1-29(2)24(30)12-14-33-26(34-15-13-25(31)32)20-5-3-4-18(16-20)6-10-22-11-8-19-7-9-21(27)17-23(19)28-22/h3-11,16-17,26H,12-15H2,1-2H3,(H,31,32)/b10-6+
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n/an/a 3.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50001285
PNG
((E)-3-((3-(2-(7-chloroquinolin-2-yl)vinyl)phenyl)(...)
Show SMILES CN(C)C(=O)CCSC(SCCC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C26H27ClN2O3S2/c1-29(2)24(30)12-14-33-26(34-15-13-25(31)32)20-5-3-4-18(16-20)6-10-22-11-8-19-7-9-21(27)17-23(19)28-22/h3-11,16-17,26H,12-15H2,1-2H3,(H,31,32)/b10-6+
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n/an/a 3.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))		BDBM50280218
PNG
(CHEMBL281308 | {1-Phenethyl-4-phenyl-1-[4-(quinoli...)
Show SMILES OC(=O)CSC(CCCc1ccccc1)(CCc1ccccc1)c1ccc(OCc2ccc3ccccc3n2)cc1
Show InChI InChI=1S/C36H35NO3S/c38-35(39)27-41-36(25-23-29-12-5-2-6-13-29,24-9-14-28-10-3-1-4-11-28)31-18-21-33(22-19-31)40-26-32-20-17-30-15-7-8-16-34(30)37-32/h1-8,10-13,15-22H,9,14,23-27H2,(H,38,39)
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n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was tested for the inhibition of binding of [125I]- L- 691,831 binding to 5-lipoxygenase activating protein (FLAP)

Bioorg Med Chem Lett 2: 1395-1398 (1992)


Article DOI: 10.1016/S0960-894X(00)80520-X
BindingDB Entry DOI: 10.7270/Q2028RGQ
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280705
PNG
(CHEMBL15306 | Sodium; (S)-3-{(R)-1-[3-(7-chloro-qu...)
Show SMILES C[C@H](CS[C@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280692
PNG
(CHEMBL15419 | Sodium; 3-[1-[3-(7-chloro-quinolin-2...)
Show SMILES CC(C)c1ccccc1CCC(SCC(C)C([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C32H34ClNO3S/c1-21(2)29-10-5-4-7-23(29)13-16-31(38-20-22(3)32(35)36)25-8-6-9-28(17-25)37-19-27-15-12-24-11-14-26(33)18-30(24)34-27/h4-12,14-15,17-18,21-22,31H,13,16,19-20H2,1-3H3,(H,35,36)/p-1
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n/an/a 6.30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280700
PNG
(CHEMBL15481 | Sodium; 3-{1-[3-(7-chloro-quinolin-2...)
Show SMILES [O-]C(=O)CCSC(CCc1ccccc1)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C28H26ClNO3S/c29-23-12-10-21-11-13-24(30-26(21)18-23)19-33-25-8-4-7-22(17-25)27(34-16-15-28(31)32)14-9-20-5-2-1-3-6-20/h1-8,10-13,17-18,27H,9,14-16,19H2,(H,31,32)/p-1
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n/an/a 6.5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280688
PNG
(CHEMBL429975 | Sodium; 2-{1-[3-(7-chloro-quinolin-...)
Show SMILES CCC(CSC(CCc1ccccc1C(=O)NS(=O)(=O)c1ccccc1C)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C38H37ClN2O6S2/c1-3-26(38(43)44)24-48-35(29-11-8-12-32(21-29)47-23-31-19-16-28-15-18-30(39)22-34(28)40-31)20-17-27-10-5-6-13-33(27)37(42)41-49(45,46)36-14-7-4-9-25(36)2/h4-16,18-19,21-22,26,35H,3,17,20,23-24H2,1-2H3,(H,41,42)(H,43,44)/p-1
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n/an/a 6.5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280706
PNG
(CHEMBL277533 | Sodium; (R)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50029600
PNG
(5-Bromo-2-(4-fluoro-phenyl)-3-(4-methanesulfonyl-p...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cc(Br)sc1-c1ccc(F)cc1
Show InChI InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-16(18)22-17(15)12-2-6-13(19)7-3-12/h2-10H,1H3
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n/an/a 7n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against human recombinant Prostaglandin G/H synthase 2 expressed in microsomes taken from baculovirus infected Sf...

Bioorg Med Chem Lett 6: 87-92 (1996)


Article DOI: 10.1016/0960-894X(95)00564-A
BindingDB Entry DOI: 10.7270/Q20C4VR4
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280706
PNG
(CHEMBL277533 | Sodium; (R)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280711
PNG
(3-{1-[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-5-...)
Show SMILES CC(CCC(SCCC(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)CC(=O)N(C)C
Show InChI InChI=1S/C28H33ClN2O4S/c1-19(15-27(32)31(2)3)7-12-26(36-14-13-28(33)34)21-5-4-6-24(16-21)35-18-23-11-9-20-8-10-22(29)17-25(20)30-23/h4-6,8-11,16-17,19,26H,7,12-15,18H2,1-3H3,(H,33,34)
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n/an/a 8.60n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280704
PNG
(3-[[3-(7-Chloro-quinolin-2-ylmethoxy)-phenyl]-(2-d...)
Show SMILES CN(C)C(=O)CCSC(SCCC(O)=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C25H27ClN2O4S2/c1-28(2)23(29)10-12-33-25(34-13-11-24(30)31)18-4-3-5-21(14-18)32-16-20-9-7-17-6-8-19(26)15-22(17)27-20/h3-9,14-15,25H,10-13,16H2,1-2H3,(H,30,31)
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n/an/a 14n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280696
PNG
(CHEMBL274913 | Sodium; (S)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m1/s1
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n/an/a 17n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280696
PNG
(CHEMBL274913 | Sodium; (S)-3-{(S)-1-[3-(7-chloro-q...)
Show SMILES C[C@H](CS[C@@H](CCc1ccccc1C(C)(C)O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C([O-])=O
Show InChI InChI=1S/C32H34ClNO4S/c1-21(31(35)36)20-39-30(16-13-22-7-4-5-10-28(22)32(2,3)37)24-8-6-9-27(17-24)38-19-26-15-12-23-11-14-25(33)18-29(23)34-26/h4-12,14-15,17-18,21,30,37H,13,16,19-20H2,1-3H3,(H,35,36)/p-1/t21-,30+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))		BDBM50006805
PNG
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Show SMILES CC(C)c1ccc2n(Cc3ccc(Cl)cc3)c(CC(C)(C)C(O)=O)c(SC(C)(C)C)c2c1
Show InChI InChI=1S/C27H34ClNO2S/c1-17(2)19-10-13-22-21(14-19)24(32-26(3,4)5)23(15-27(6,7)25(30)31)29(22)16-18-8-11-20(28)12-9-18/h8-14,17H,15-16H2,1-7H3,(H,30,31)
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n/an/a 23n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was tested for the inhibition of binding of [125I]- L- 691,831 binding to 5-lipoxygenase activating protein (FLAP)

Bioorg Med Chem Lett 2: 1395-1398 (1992)


Article DOI: 10.1016/S0960-894X(00)80520-X
BindingDB Entry DOI: 10.7270/Q2028RGQ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50280690
PNG
(3-[{3-[2-(7-Chloro-quinolin-2-yl)-ethyl]-phenyl}-(...)
Show SMILES CN(C)C(=O)CCSC(SCCC(O)=O)c1cccc(CCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C26H29ClN2O3S2/c1-29(2)24(30)12-14-33-26(34-15-13-25(31)32)20-5-3-4-18(16-20)6-10-22-11-8-19-7-9-21(27)17-23(19)28-22/h3-5,7-9,11,16-17,26H,6,10,12-15H2,1-2H3,(H,31,32)
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n/an/a 26n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined (Experiment 1)

Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50286048
PNG
(2-Bromo-3-(4-fluoro-phenyl)-4-(4-methanesulfonyl-p...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1csc(Br)c1-c1ccc(F)cc1
Show InChI InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-22-17(18)16(15)12-2-6-13(19)7-3-12/h2-10H,1H3
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n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against human recombinant Prostaglandin G/H synthase 2 expressed in microsomes taken from baculovirus infected Sf...

Bioorg Med Chem Lett 6: 87-92 (1996)


Article DOI: 10.1016/0960-894X(95)00564-A
BindingDB Entry DOI: 10.7270/Q20C4VR4
More data for this
Ligand-Target Pair
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