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PubMed code 9873432

Compile data set for download or QSAR
Found 52 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
Endothelin-1 receptor


(RAT)		BDBM50070888
PNG
(CHEMBL298725 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1F)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H23FN2O7S/c1-34-21-8-6-16(12-18(21)28)25(31)17(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-7-19-20(13-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-17-
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n/an/a 0.0320n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070884
PNG
(CHEMBL48907 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-18-8-5-16(6-9-18)25(30)19(11-15-12-22(34-2)26(36-4)23(13-15)35-3)24(27(31)32)17-7-10-20-21(14-17)29-37-28-20/h5-10,12-14H,11H2,1-4H3,(H,31,32)/p-1/b24-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070886
PNG
(CHEMBL51234 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1Cl)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H23ClN2O7S/c1-34-21-8-6-16(12-18(21)28)25(31)17(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-7-19-20(13-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-17-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50034263
PNG
(CHEMBL25438 | PD-156707 | Sodium; (Z)-2-benzo[1,3]...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C28H26O9/c1-32-19-8-5-17(6-9-19)26(29)20(11-16-12-23(33-2)27(35-4)24(13-16)34-3)25(28(30)31)18-7-10-21-22(14-18)37-15-36-21/h5-10,12-14H,11,15H2,1-4H3,(H,30,31)/p-1/b25-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070881
PNG
(CHEMBL295483 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1C)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C28H26N2O7S/c1-15-10-18(7-9-22(15)34-2)26(31)19(11-16-12-23(35-3)27(37-5)24(13-16)36-4)25(28(32)33)17-6-8-20-21(14-17)30-38-29-20/h6-10,12-14H,11H2,1-5H3,(H,32,33)/p-1/b25-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50051007
PNG
((2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-dibutylcarbam...)
Show SMILES CCCCN(CCCC)C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(OC)cc1)C(O)=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C29H38N2O6/c1-4-6-14-30(15-7-5-2)26(32)18-31-17-23(21-10-13-24-25(16-21)37-19-36-24)27(29(33)34)28(31)20-8-11-22(35-3)12-9-20/h8-13,16,23,27-28H,4-7,14-15,17-19H2,1-3H3,(H,33,34)/t23-,27-,28+/m1/s1
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070882
PNG
((Z)-2-Benzo[1,2,5]thiadiazol-5-yl-4-(2-fluoro-4-me...)
Show SMILES COc1ccc(C(=O)C(\Cc2cc(OC)c(OC)c(OC)c2)=C(/C([O-])=O)c2ccc3nsnc3c2)c(F)c1
Show InChI InChI=1S/C27H23FN2O7S/c1-34-16-6-7-17(19(28)13-16)25(31)18(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-8-20-21(12-15)30-38-29-20/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070877
PNG
(CHEMBL262000 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc2OCCc2c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C26H20N2O5S/c1-32-19-6-3-16(4-7-19)25(29)20(13-15-2-9-23-17(12-15)10-11-33-23)24(26(30)31)18-5-8-21-22(14-18)28-34-27-21/h2-9,12,14H,10-11,13H2,1H3,(H,30,31)/p-1/b24-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070871
PNG
(CHEMBL431160 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1OC)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-10-7-15(8-11-18)24(28)19(13-16-5-3-4-6-22(16)32-2)23(25(29)30)17-9-12-20-21(14-17)27-33-26-20/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070890
PNG
(CHEMBL51890 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cccc(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-9-6-16(7-10-18)24(28)20(13-15-4-3-5-19(12-15)32-2)23(25(29)30)17-8-11-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070873
PNG
(CHEMBL301577 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2cc(OC)c(OC)c(OC)c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H28N2O9S/c1-35-21-10-15(11-22(36-2)27(21)39-5)9-18(25(29(33)34)16-7-8-19-20(12-16)31-41-30-19)26(32)17-13-23(37-3)28(40-6)24(14-17)38-4/h7-8,10-14H,9H2,1-6H3,(H,33,34)/p-1/b25-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070892
PNG
(CHEMBL299572 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cccc(c1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-18-7-5-6-17(13-18)25(30)19(10-15-11-22(34-2)26(36-4)23(12-15)35-3)24(27(31)32)16-8-9-20-21(14-16)29-37-28-20/h5-9,11-14H,10H2,1-4H3,(H,31,32)/p-1/b24-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070876
PNG
(CHEMBL299328 | Sodium; (Z)-4-benzo[1,3]dioxol-5-yl...)
Show SMILES COc1cc(C\C(C(=O)c2ccc3OCOc3c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C27H22N2O8S/c1-33-22-9-14(10-23(34-2)26(22)35-3)8-17(25(30)16-5-7-20-21(12-16)37-13-36-20)24(27(31)32)15-4-6-18-19(11-15)29-38-28-18/h4-7,9-12H,8,13H2,1-3H3,(H,31,32)/p-1/b24-17-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50057155
PNG
((Z)-2-Benzo[1,3]dioxol-5-yl-3-benzyl-4-(4-methoxy-...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1)=C(/C([O-])=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C25H20O6/c1-29-19-10-7-17(8-11-19)24(26)20(13-16-5-3-2-4-6-16)23(25(27)28)18-9-12-21-22(14-18)31-15-30-21/h2-12,14H,13,15H2,1H3,(H,27,28)/p-1/b23-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070891
PNG
(CHEMBL48458 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(F)cc2OC)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C27H23FN2O7S/c1-34-21-13-16(28)6-7-17(21)25(31)18(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-8-19-20(12-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070879
PNG
(CHEMBL299521 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(OC)c(F)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H19FN2O5S/c1-32-17-7-4-15(5-8-17)24(29)18(11-14-3-10-22(33-2)19(26)12-14)23(25(30)31)16-6-9-20-21(13-16)28-34-27-20/h3-10,12-13H,11H2,1-2H3,(H,30,31)/p-1/b23-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070869
PNG
(CHEMBL48411 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccccc1C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-21-8-6-5-7-17(21)25(30)18(11-15-12-22(34-2)26(36-4)23(13-15)35-3)24(27(31)32)16-9-10-19-20(14-16)29-37-28-19/h5-10,12-14H,11H2,1-4H3,(H,31,32)/p-1/b24-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070889
PNG
(CHEMBL51030 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(SC)cc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O4S2/c1-31-18-8-5-16(6-9-18)24(28)20(13-15-3-10-19(32-2)11-4-15)23(25(29)30)17-7-12-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070878
PNG
(CHEMBL48881 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C24H18N2O4S/c1-30-18-10-7-16(8-11-18)23(27)19(13-15-5-3-2-4-6-15)22(24(28)29)17-9-12-20-21(14-17)26-31-25-20/h2-12,14H,13H2,1H3,(H,28,29)/p-1/b22-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070868
PNG
(CHEMBL49675 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1cc(C\C(C(=O)c2ccc3OCCc3c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C28H24N2O7S/c1-34-23-11-15(12-24(35-2)27(23)36-3)10-19(26(31)18-5-7-22-16(13-18)8-9-37-22)25(28(32)33)17-4-6-20-21(14-17)30-38-29-20/h4-7,11-14H,8-10H2,1-3H3,(H,32,33)/p-1/b25-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070874
PNG
(CHEMBL301971 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(C\C(C(=O)c2ccc(OC)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-8-3-15(4-9-18)13-20(24(28)16-5-10-19(32-2)11-6-16)23(25(29)30)17-7-12-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070872
PNG
(CHEMBL276362 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC(C)C)c(OC(C)C)c(OC(C)C)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C33H36N2O7S/c1-18(2)40-28-15-21(16-29(41-19(3)4)32(28)42-20(5)6)14-25(31(36)22-8-11-24(39-7)12-9-22)30(33(37)38)23-10-13-26-27(17-23)35-43-34-26/h8-13,15-20H,14H2,1-7H3,(H,37,38)/p-1/b30-25-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070880
PNG
(CHEMBL48315 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(C)C)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H28N2O7S/c1-16(2)38-20-9-6-18(7-10-20)27(32)21(12-17-13-24(35-3)28(37-5)25(14-17)36-4)26(29(33)34)19-8-11-22-23(15-19)31-39-30-22/h6-11,13-16H,12H2,1-5H3,(H,33,34)/p-1/b26-21-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070883
PNG
(CHEMBL300201 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(C)C)c(F)c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H27FN2O7S/c1-15(2)39-23-9-7-18(13-20(23)30)27(33)19(10-16-11-24(36-3)28(38-5)25(12-16)37-4)26(29(34)35)17-6-8-21-22(14-17)32-40-31-21/h6-9,11-15H,10H2,1-5H3,(H,34,35)/p-1/b26-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070870
PNG
(CHEMBL52535 | Sodium; (Z)-3-benzo[1,3]dioxol-5-ylm...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc2OCOc2c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H18N2O6S/c1-31-17-6-3-15(4-7-17)24(28)18(10-14-2-9-21-22(11-14)33-13-32-21)23(25(29)30)16-5-8-19-20(12-16)27-34-26-19/h2-9,11-12H,10,13H2,1H3,(H,29,30)/p-1/b23-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50051007
PNG
((2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-dibutylcarbam...)
Show SMILES CCCCN(CCCC)C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(OC)cc1)C(O)=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C29H38N2O6/c1-4-6-14-30(15-7-5-2)26(32)18-31-17-23(21-10-13-24-25(16-21)37-19-36-24)27(29(33)34)28(31)20-8-11-22(35-3)12-9-20/h8-13,16,23,27-28H,4-7,14-15,17-19H2,1-3H3,(H,33,34)/t23-,27-,28+/m1/s1
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070888
PNG
(CHEMBL298725 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1F)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H23FN2O7S/c1-34-21-8-6-16(12-18(21)28)25(31)17(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-7-19-20(13-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-17-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070875
PNG
(CHEMBL433090 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(F)F)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C27H22F2N2O7S/c1-35-21-11-14(12-22(36-2)25(21)37-3)10-18(24(32)15-4-7-17(8-5-15)38-27(28)29)23(26(33)34)16-6-9-19-20(13-16)31-39-30-19/h4-9,11-13,27H,10H2,1-3H3,(H,33,34)/p-1/b23-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070886
PNG
(CHEMBL51234 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1Cl)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H23ClN2O7S/c1-34-21-8-6-16(12-18(21)28)25(31)17(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-7-19-20(13-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-17-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070872
PNG
(CHEMBL276362 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC(C)C)c(OC(C)C)c(OC(C)C)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C33H36N2O7S/c1-18(2)40-28-15-21(16-29(41-19(3)4)32(28)42-20(5)6)14-25(31(36)22-8-11-24(39-7)12-9-22)30(33(37)38)23-10-13-26-27(17-23)35-43-34-26/h8-13,15-20H,14H2,1-7H3,(H,37,38)/p-1/b30-25-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070881
PNG
(CHEMBL295483 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1C)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C28H26N2O7S/c1-15-10-18(7-9-22(15)34-2)26(31)19(11-16-12-23(35-3)27(37-5)24(13-16)36-4)25(28(32)33)17-6-8-20-21(14-17)30-38-29-20/h6-10,12-14H,11H2,1-5H3,(H,32,33)/p-1/b25-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070883
PNG
(CHEMBL300201 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(C)C)c(F)c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H27FN2O7S/c1-15(2)39-23-9-7-18(13-20(23)30)27(33)19(10-16-11-24(36-3)28(38-5)25(12-16)37-4)26(29(34)35)17-6-8-21-22(14-17)32-40-31-21/h6-9,11-15H,10H2,1-5H3,(H,34,35)/p-1/b26-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070873
PNG
(CHEMBL301577 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2cc(OC)c(OC)c(OC)c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H28N2O9S/c1-35-21-10-15(11-22(36-2)27(21)39-5)9-18(25(29(33)34)16-7-8-19-20(12-16)31-41-30-19)26(32)17-13-23(37-3)28(40-6)24(14-17)38-4/h7-8,10-14H,9H2,1-6H3,(H,33,34)/p-1/b25-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50034263
PNG
(CHEMBL25438 | PD-156707 | Sodium; (Z)-2-benzo[1,3]...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C28H26O9/c1-32-19-8-5-17(6-9-19)26(29)20(11-16-12-23(33-2)27(35-4)24(13-16)34-3)25(28(30)31)18-7-10-21-22(14-18)37-15-36-21/h5-10,12-14H,11,15H2,1-4H3,(H,30,31)/p-1/b25-20-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070884
PNG
(CHEMBL48907 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-18-8-5-16(6-9-18)25(30)19(11-15-12-22(34-2)26(36-4)23(13-15)35-3)24(27(31)32)17-7-10-20-21(14-17)29-37-28-20/h5-10,12-14H,11H2,1-4H3,(H,31,32)/p-1/b24-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070876
PNG
(CHEMBL299328 | Sodium; (Z)-4-benzo[1,3]dioxol-5-yl...)
Show SMILES COc1cc(C\C(C(=O)c2ccc3OCOc3c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C27H22N2O8S/c1-33-22-9-14(10-23(34-2)26(22)35-3)8-17(25(30)16-5-7-20-21(12-16)37-13-36-20)24(27(31)32)15-4-6-18-19(11-15)29-38-28-18/h4-7,9-12H,8,13H2,1-3H3,(H,31,32)/p-1/b24-17-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070868
PNG
(CHEMBL49675 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1cc(C\C(C(=O)c2ccc3OCCc3c2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C28H24N2O7S/c1-34-23-11-15(12-24(35-2)27(23)36-3)10-19(26(31)18-5-7-22-16(13-18)8-9-37-22)25(28(32)33)17-4-6-20-21(14-17)30-38-29-20/h4-7,11-14H,8-10H2,1-3H3,(H,32,33)/p-1/b25-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070869
PNG
(CHEMBL48411 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccccc1C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-21-8-6-5-7-17(21)25(30)18(11-15-12-22(34-2)26(36-4)23(13-15)35-3)24(27(31)32)16-9-10-19-20(14-16)29-37-28-19/h5-10,12-14H,11H2,1-4H3,(H,31,32)/p-1/b24-18-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070880
PNG
(CHEMBL48315 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(C)C)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C29H28N2O7S/c1-16(2)38-20-9-6-18(7-10-20)27(32)21(12-17-13-24(35-3)28(37-5)25(14-17)36-4)26(29(33)34)19-8-11-22-23(15-19)31-39-30-22/h6-11,13-16H,12H2,1-5H3,(H,33,34)/p-1/b26-21-
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n/an/a 550n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(RAT)		BDBM50070887
PNG
(CHEMBL52338 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(OC(C)(C)C)cc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C28H26N2O5S/c1-28(2,3)35-21-10-5-17(6-11-21)15-22(26(31)18-7-12-20(34-4)13-8-18)25(27(32)33)19-9-14-23-24(16-19)30-36-29-23/h5-14,16H,15H2,1-4H3,(H,32,33)/p-1/b25-22-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to rat aorta membranes Endothelin A receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070871
PNG
(CHEMBL431160 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1OC)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-10-7-15(8-11-18)24(28)19(13-16-5-3-4-6-22(16)32-2)23(25(29)30)17-9-12-20-21(14-17)27-33-26-20/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-19-
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Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070890
PNG
(CHEMBL51890 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1cccc(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-9-6-16(7-10-18)24(28)20(13-15-4-3-5-19(12-15)32-2)23(25(29)30)17-8-11-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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n/an/a 1.00E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070878
PNG
(CHEMBL48881 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C24H18N2O4S/c1-30-18-10-7-16(8-11-18)23(27)19(13-15-5-3-2-4-6-15)22(24(28)29)17-9-12-20-21(14-17)26-31-25-20/h2-12,14H,13H2,1H3,(H,28,29)/p-1/b22-19-
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n/an/a 1.20E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070877
PNG
(CHEMBL262000 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc2OCCc2c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C26H20N2O5S/c1-32-19-6-3-16(4-7-19)25(29)20(13-15-2-9-23-17(12-15)10-11-33-23)24(26(30)31)18-5-8-21-22(14-18)28-34-27-21/h2-9,12,14H,10-11,13H2,1H3,(H,30,31)/p-1/b24-20-
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n/an/a 1.40E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070870
PNG
(CHEMBL52535 | Sodium; (Z)-3-benzo[1,3]dioxol-5-ylm...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc2OCOc2c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H18N2O6S/c1-31-17-6-3-15(4-7-17)24(28)18(10-14-2-9-21-22(11-14)33-13-32-21)23(25(29)30)16-5-8-19-20(12-16)27-34-26-19/h2-9,11-12H,10,13H2,1H3,(H,29,30)/p-1/b23-18-
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n/an/a 1.50E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070887
PNG
(CHEMBL52338 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(OC(C)(C)C)cc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C28H26N2O5S/c1-28(2,3)35-21-10-5-17(6-11-21)15-22(26(31)18-7-12-20(34-4)13-8-18)25(27(32)33)19-9-14-23-24(16-19)30-36-29-23/h5-14,16H,15H2,1-4H3,(H,32,33)/p-1/b25-22-
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n/an/a 1.60E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070892
PNG
(CHEMBL299572 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cccc(c1)C(=O)C(\Cc1cc(OC)c(OC)c(OC)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C27H24N2O7S/c1-33-18-7-5-6-17(13-18)25(30)19(10-15-11-22(34-2)26(36-4)23(12-15)35-3)24(27(31)32)16-8-9-20-21(14-16)29-37-28-20/h5-9,11-14H,10H2,1-4H3,(H,31,32)/p-1/b24-19-
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n/an/a 1.80E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070874
PNG
(CHEMBL301971 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(C\C(C(=O)c2ccc(OC)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc1
Show InChI InChI=1S/C25H20N2O5S/c1-31-18-8-3-15(4-9-18)13-20(24(28)16-5-10-19(32-2)11-6-16)23(25(29)30)17-7-12-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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n/an/a 1.80E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070875
PNG
(CHEMBL433090 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1cc(C\C(C(=O)c2ccc(OC(F)F)cc2)=C(\C([O-])=O)c2ccc3nsnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C27H22F2N2O7S/c1-35-21-11-14(12-22(36-2)25(21)37-3)10-18(24(32)15-4-7-17(8-5-15)38-27(28)29)23(26(33)34)16-6-9-19-20(13-16)31-39-30-19/h4-9,11-13,27H,10H2,1-3H3,(H,33,34)/p-1/b23-18-
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070879
PNG
(CHEMBL299521 | Sodium; (Z)-2-benzo[1,2,5]thiadiazo...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(OC)c(F)c1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H19FN2O5S/c1-32-17-7-4-15(5-8-17)24(29)18(11-14-3-10-22(33-2)19(26)12-14)23(25(30)31)16-6-9-20-21(13-16)28-34-27-20/h3-10,12-13H,11H2,1-2H3,(H,30,31)/p-1/b23-18-
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n/an/a 2.90E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50070889
PNG
(CHEMBL51030 | Sodium; (Z)-2-benzo[1,2,5]thiadiazol...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccc(SC)cc1)=C(/C([O-])=O)c1ccc2nsnc2c1
Show InChI InChI=1S/C25H20N2O4S2/c1-31-18-8-5-16(6-9-18)24(28)20(13-15-3-10-19(32-2)11-4-15)23(25(29)30)17-7-12-21-22(14-17)27-33-26-21/h3-12,14H,13H2,1-2H3,(H,29,30)/p-1/b23-20-
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n/an/a 3.20E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
Endothelin receptor type B


(Sus scrofa)		BDBM50057155
PNG
((Z)-2-Benzo[1,3]dioxol-5-yl-3-benzyl-4-(4-methoxy-...)
Show SMILES COc1ccc(cc1)C(=O)C(\Cc1ccccc1)=C(/C([O-])=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C25H20O6/c1-29-19-10-7-17(8-11-19)24(26)20(13-16-5-3-2-4-6-16)23(25(27)28)18-9-12-21-22(14-18)31-15-30-21/h2-12,14H,13,15H2,1H3,(H,27,28)/p-1/b23-20-
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n/an/a 4.55E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
In vitro ability to inhibit specific [125I]ET1 binding to porcine kidney (inner medulla) membranes Endothelin B receptor

Bioorg Med Chem Lett 8: 1771-6 (1999)


BindingDB Entry DOI: 10.7270/Q2TM7BM4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%