Found 34 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50212952
(CHEMBL46150)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1)C1OCC=C1 |c:41| Show InChI InChI=1S/C30H28N6O2/c1-2-3-10-28-31-26-16-15-22(27-9-6-17-38-27)18-25(26)30(37)36(28)19-20-11-13-21(14-12-20)23-7-4-5-8-24(23)29-32-34-35-33-29/h4-9,11-16,18,27H,2-3,10,17,19H2,1H3,(H,32,33,34,35) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50049207
(2-Butyl-6-(1-methoxy-1-methyl-ethyl)-3-[2'-(1H-tet...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)(C)OC Show InChI InChI=1S/C30H32N6O2/c1-5-6-11-27-31-26-17-16-22(30(2,3)38-4)18-25(26)29(37)36(27)19-20-12-14-21(15-13-20)23-9-7-8-10-24(23)28-32-34-35-33-28/h7-10,12-18H,5-6,11,19H2,1-4H3,(H,32,33,34,35) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
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| Article
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50212954
(CHEMBL295114)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1)C1CCCO1 Show InChI InChI=1S/C30H30N6O2/c1-2-3-10-28-31-26-16-15-22(27-9-6-17-38-27)18-25(26)30(37)36(28)19-20-11-13-21(14-12-20)23-7-4-5-8-24(23)29-32-34-35-33-29/h4-5,7-8,11-16,18,27H,2-3,6,9-10,17,19H2,1H3,(H,32,33,34,35) | PDB
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282805
(2-Butyl-6-((2R,3aR)-2-methyl-hexahydro-isoxazolo[2...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C)C[C@H]2CCCCN2O1 Show InChI InChI=1S/C34H37N7O2/c1-3-4-12-31-35-30-18-17-25(34(2)21-26-9-7-8-19-41(26)43-34)20-29(30)33(42)40(31)22-23-13-15-24(16-14-23)27-10-5-6-11-28(27)32-36-38-39-37-32/h5-6,10-11,13-18,20,26H,3-4,7-9,12,19,21-22H2,1-2H3,(H,36,37,38,39)/t26-,34-/m1/s1 | PDB
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| Article
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282792
(2-Butyl-6-((2S,3aR)-2-methyl-hexahydro-pyrrolo[1,2...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@]1(C)C[C@H]2CCCN2O1 Show InChI InChI=1S/C33H35N7O2/c1-3-4-11-30-34-29-17-16-24(33(2)20-25-8-7-18-40(25)42-33)19-28(29)32(41)39(30)21-22-12-14-23(15-13-22)26-9-5-6-10-27(26)31-35-37-38-36-31/h5-6,9-10,12-17,19,25H,3-4,7-8,11,18,20-21H2,1-2H3,(H,35,36,37,38)/t25-,33+/m1/s1 | PDB
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| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282794
(5-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1CC(=NO1)C(=O)OCC |c:40| Show InChI InChI=1S/C32H31N7O4/c1-3-5-10-29-33-26-16-15-22(28-18-27(36-43-28)32(41)42-4-2)17-25(26)31(40)39(29)19-20-11-13-21(14-12-20)23-8-6-7-9-24(23)30-34-37-38-35-30/h6-9,11-17,28H,3-5,10,18-19H2,1-2H3,(H,34,35,37,38) | PDB
Reactome pathway
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PC cid
PC sid
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| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50049207
(2-Butyl-6-(1-methoxy-1-methyl-ethyl)-3-[2'-(1H-tet...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)(C)OC Show InChI InChI=1S/C30H32N6O2/c1-5-6-11-27-31-26-17-16-22(30(2,3)38-4)18-25(26)29(37)36(27)19-20-12-14-21(15-13-20)23-9-7-8-10-24(23)28-32-34-35-33-28/h7-10,12-18H,5-6,11,19H2,1-4H3,(H,32,33,34,35) | PDB
Reactome pathway
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| Article
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282798
(2-Butyl-6-(2S,3aR)-hexahydro-pyrrolo[1,2-b]isoxazo...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@H]1C[C@H]2CCCN2O1 Show InChI InChI=1S/C32H33N7O2/c1-2-3-10-30-33-28-16-15-23(29-19-24-7-6-17-39(24)41-29)18-27(28)32(40)38(30)20-21-11-13-22(14-12-21)25-8-4-5-9-26(25)31-34-36-37-35-31/h4-5,8-9,11-16,18,24,29H,2-3,6-7,10,17,19-20H2,1H3,(H,34,35,36,37)/t24-,29+/m1/s1 | PDB
Reactome pathway
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| Article
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282806
(2-Butyl-6-((2S,3aR)-2-hydroxymethyl-hexahydro-pyrr...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@]1(CO)C[C@H]2CCCN2O1 Show InChI InChI=1S/C33H35N7O3/c1-2-3-10-30-34-29-16-15-24(33(21-41)19-25-7-6-17-40(25)43-33)18-28(29)32(42)39(30)20-22-11-13-23(14-12-22)26-8-4-5-9-27(26)31-35-37-38-36-31/h4-5,8-9,11-16,18,25,41H,2-3,6-7,10,17,19-21H2,1H3,(H,35,36,37,38)/t25-,33-/m1/s1 | PDB
Reactome pathway
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UniProtKB/SwissProt
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PC cid
PC sid
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Similars
| Article
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282802
(2-Butyl-6-(2S,3aR)-hexahydro-isoxazolo[2,3-a]pyrid...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@H]1C[C@H]2CCCCN2O1 Show InChI InChI=1S/C33H35N7O2/c1-2-3-11-31-34-29-17-16-24(30-20-25-8-6-7-18-40(25)42-30)19-28(29)33(41)39(31)21-22-12-14-23(15-13-22)26-9-4-5-10-27(26)32-35-37-38-36-32/h4-5,9-10,12-17,19,25,30H,2-3,6-8,11,18,20-21H2,1H3,(H,35,36,37,38)/t25-,30+/m1/s1 | PDB
Reactome pathway
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| Article
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282818
(2-Butyl-6-((2S,3aR)-6,6-dimethyl-hexahydro-pyrrolo...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@H]1C[C@H]2CCC(C)(C)N2O1 Show InChI InChI=1S/C34H37N7O2/c1-4-5-10-31-35-29-16-15-24(30-20-25-17-18-34(2,3)41(25)43-30)19-28(29)33(42)40(31)21-22-11-13-23(14-12-22)26-8-6-7-9-27(26)32-36-38-39-37-32/h6-9,11-16,19,25,30H,4-5,10,17-18,20-21H2,1-3H3,(H,36,37,38,39)/t25-,30+/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50212953
(CHEMBL47914)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1)-c1cccs1 Show InChI InChI=1S/C30H26N6OS/c1-2-3-10-28-31-26-16-15-22(27-9-6-17-38-27)18-25(26)30(37)36(28)19-20-11-13-21(14-12-20)23-7-4-5-8-24(23)29-32-34-35-33-29/h4-9,11-18H,2-3,10,19H2,1H3,(H,32,33,34,35) | PDB
UniProtKB/SwissProt
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
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| Article
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282807
((2S,3aR)-2-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C[C@H]2CCCN2O1)C(O)=O Show InChI InChI=1S/C33H33N7O4/c1-2-3-10-29-34-28-16-15-23(33(32(42)43)19-24-7-6-17-40(24)44-33)18-27(28)31(41)39(29)20-21-11-13-22(14-12-21)25-8-4-5-9-26(25)30-35-37-38-36-30/h4-5,8-9,11-16,18,24H,2-3,6-7,10,17,19-20H2,1H3,(H,42,43)(H,35,36,37,38)/t24-,33+/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282808
(2-Butyl-6-((2S,3aR)-2-methyl-hexahydro-isoxazolo[2...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@]1(C)C[C@H]2CCCCN2O1 Show InChI InChI=1S/C34H37N7O2/c1-3-4-12-31-35-30-18-17-25(34(2)21-26-9-7-8-19-41(26)43-34)20-29(30)33(42)40(31)22-23-13-15-24(16-14-23)27-10-5-6-11-28(27)32-36-38-39-37-32/h5-6,10-11,13-18,20,26H,3-4,7-9,12,19,21-22H2,1-2H3,(H,36,37,38,39)/t26-,34+/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50212951
(CHEMBL47449)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1)-c1ccco1 Show InChI InChI=1S/C30H26N6O2/c1-2-3-10-28-31-26-16-15-22(27-9-6-17-38-27)18-25(26)30(37)36(28)19-20-11-13-21(14-12-20)23-7-4-5-8-24(23)29-32-34-35-33-29/h4-9,11-18H,2-3,10,19H2,1H3,(H,32,33,34,35) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
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| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282791
(2-Butyl-6-((2R,3aR)-2-methyl-hexahydro-pyrrolo[1,2...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C)C[C@H]2CCCN2O1 Show InChI InChI=1S/C33H35N7O2/c1-3-4-11-30-34-29-17-16-24(33(2)20-25-8-7-18-40(25)42-33)19-28(29)32(41)39(30)21-22-12-14-23(15-13-22)26-9-5-6-10-27(26)31-35-37-38-36-31/h5-6,9-10,12-17,19,25H,3-4,7-8,11,18,20-21H2,1-2H3,(H,35,36,37,38)/t25-,33-/m1/s1 | PDB
Reactome pathway
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UniChem
Patents
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| Article
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282813
(2-Butyl-6-((2R,3aR)-2-phenyl-hexahydro-pyrrolo[1,2...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C[C@H]2CCCN2O1)c1ccccc1 Show InChI InChI=1S/C38H37N7O2/c1-2-3-15-35-39-34-21-20-29(38(28-10-5-4-6-11-28)24-30-12-9-22-45(30)47-38)23-33(34)37(46)44(35)25-26-16-18-27(19-17-26)31-13-7-8-14-32(31)36-40-42-43-41-36/h4-8,10-11,13-14,16-21,23,30H,2-3,9,12,15,22,24-25H2,1H3,(H,40,41,42,43)/t30-,38-/m1/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282817
((2S,3aR)-2-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C[C@H]2CCCN2O1)C(=O)N(C)C Show InChI InChI=1S/C35H38N8O3/c1-4-5-12-31-36-30-18-17-25(35(34(45)41(2)3)21-26-9-8-19-43(26)46-35)20-29(30)33(44)42(31)22-23-13-15-24(16-14-23)27-10-6-7-11-28(27)32-37-39-40-38-32/h6-7,10-11,13-18,20,26H,4-5,8-9,12,19,21-22H2,1-3H3,(H,37,38,39,40)/t26-,35+/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282819
(2-Butyl-6-((2R,3aR)-2-ethyl-hexahydro-pyrrolo[1,2-...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(CC)C[C@H]2CCCN2O1 Show InChI InChI=1S/C34H37N7O2/c1-3-5-12-31-35-30-18-17-25(34(4-2)21-26-9-8-19-41(26)43-34)20-29(30)33(42)40(31)22-23-13-15-24(16-14-23)27-10-6-7-11-28(27)32-36-38-39-37-32/h6-7,10-11,13-18,20,26H,3-5,8-9,12,19,21-22H2,1-2H3,(H,36,37,38,39)/t26-,34-/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282809
(2-Butyl-6-[(R)-2-(piperidine-1-carbonyl)-hexahydro...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1(C[C@H]2CCCN2O1)C(=O)N1CCCCC1 Show InChI InChI=1S/C38H42N8O3/c1-2-3-13-34-39-33-19-18-28(38(24-29-10-9-22-46(29)49-38)37(48)44-20-7-4-8-21-44)23-32(33)36(47)45(34)25-26-14-16-27(17-15-26)30-11-5-6-12-31(30)35-40-42-43-41-35/h5-6,11-12,14-19,23,29H,2-4,7-10,13,20-22,24-25H2,1H3,(H,40,41,42,43)/t29-,38?/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282796
(2-Butyl-6-((2S,3aR)-3a-methyl-hexahydro-isoxazolo[...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@H]1C[C@@]2(C)CCCCN2O1 Show InChI InChI=1S/C34H37N7O2/c1-3-4-11-31-35-29-17-16-25(30-21-34(2)18-7-8-19-41(34)43-30)20-28(29)33(42)40(31)22-23-12-14-24(15-13-23)26-9-5-6-10-27(26)32-36-38-39-37-32/h5-6,9-10,12-17,20,30H,3-4,7-8,11,18-19,21-22H2,1-2H3,(H,36,37,38,39)/t30-,34+/m0/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282797
(2-Butyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@]1(C)C[C@H]2CCC(C)(C)N2O1 Show InChI InChI=1S/C35H39N7O2/c1-5-6-11-31-36-30-17-16-25(35(4)21-26-18-19-34(2,3)42(26)44-35)20-29(30)33(43)41(31)22-23-12-14-24(15-13-23)27-9-7-8-10-28(27)32-37-39-40-38-32/h7-10,12-17,20,26H,5-6,11,18-19,21-22H2,1-4H3,(H,37,38,39,40)/t26-,35+/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282814
((S)-2-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biph...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@H]1ON2CCCC2C1C(=O)OCC Show InChI InChI=1S/C35H37N7O4/c1-3-5-12-30-36-28-18-17-24(32-31(35(44)45-4-2)29-11-8-19-42(29)46-32)20-27(28)34(43)41(30)21-22-13-15-23(16-14-22)25-9-6-7-10-26(25)33-37-39-40-38-33/h6-7,9-10,13-18,20,29,31-32H,3-5,8,11-12,19,21H2,1-2H3,(H,37,38,39,40)/t29?,31?,32-/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282804
(2-Butyl-6-[(R)-2-(pyrrolidine-1-carbonyl)-hexahydr...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1(C[C@H]2CCCN2O1)C(=O)N1CCCC1 Show InChI InChI=1S/C37H40N8O3/c1-2-3-12-33-38-32-18-17-27(37(36(47)43-19-6-7-20-43)23-28-9-8-21-45(28)48-37)22-31(32)35(46)44(33)24-25-13-15-26(16-14-25)29-10-4-5-11-30(29)34-39-41-42-40-34/h4-5,10-11,13-18,22,28H,2-3,6-9,12,19-21,23-24H2,1H3,(H,39,40,41,42)/t28-,37?/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 69 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282812
(2-Butyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C)C[C@H]2CCC(C)(C)N2O1 Show InChI InChI=1S/C35H39N7O2/c1-5-6-11-31-36-30-17-16-25(35(4)21-26-18-19-34(2,3)42(26)44-35)20-29(30)33(43)41(31)22-23-12-14-24(15-13-23)27-9-7-8-10-28(27)32-37-39-40-38-32/h7-10,12-17,20,26H,5-6,11,18-19,21-22H2,1-4H3,(H,37,38,39,40)/t26-,35-/m1/s1 | PDB
Reactome pathway
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282815
(2-Butyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1CC(=NO1)c1ccc(C)cc1 |c:40| Show InChI InChI=1S/C36H33N7O2/c1-3-4-9-34-37-31-19-18-27(33-21-32(40-45-33)26-14-10-23(2)11-15-26)20-30(31)36(44)43(34)22-24-12-16-25(17-13-24)28-7-5-6-8-29(28)35-38-41-42-39-35/h5-8,10-20,33H,3-4,9,21-22H2,1-2H3,(H,38,39,41,42) | PDB
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TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282793
((2S,3aR)-2-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@]1(C[C@H]2CCCN2O1)C(=O)OC Show InChI InChI=1S/C34H35N7O4/c1-3-4-11-30-35-29-17-16-24(34(33(43)44-2)20-25-8-7-18-41(25)45-34)19-28(29)32(42)40(30)21-22-12-14-23(15-13-22)26-9-5-6-10-27(26)31-36-38-39-37-31/h5-6,9-10,12-17,19,25H,3-4,7-8,11,18,20-21H2,1-2H3,(H,36,37,38,39)/t25-,34+/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A/Type-1 angiotensin II receptor B/Type-2 angiotensin II receptor
(RAT) | BDBM50009714
(CHEMBL191 | {2-Butyl-5-chloro-3-[2'-(2H-tetrazol-5...)Show SMILES CCCCC1=NC(Cl)C(CO)N1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 |t:4| Show InChI InChI=1S/C22H25ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,19,21,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28) | PDB
UniProtKB/SwissProt
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| n/a | n/a | 82 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonist activity in rat adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282810
(2-Butyl-6-((2S,3aR)-2-ethyl-hexahydro-pyrrolo[1,2-...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@]1(CC)C[C@H]2CCCN2O1 Show InChI InChI=1S/C34H37N7O2/c1-3-5-12-31-35-30-18-17-25(34(4-2)21-26-9-8-19-41(26)43-34)20-29(30)33(42)40(31)22-23-13-15-24(16-14-23)27-10-6-7-11-28(27)32-36-38-39-37-32/h6-7,10-11,13-18,20,26H,3-5,8-9,12,19,21-22H2,1-2H3,(H,36,37,38,39)/t26-,34+/m1/s1 | PDB
Reactome pathway
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| n/a | n/a | 83 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282801
(5-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1(C)CC(=NO1)C(=O)OCC |c:41| Show InChI InChI=1S/C33H33N7O4/c1-4-6-11-29-34-27-17-16-23(33(3)19-28(37-44-33)32(42)43-5-2)18-26(27)31(41)40(29)20-21-12-14-22(15-13-21)24-9-7-8-10-25(24)30-35-38-39-36-30/h7-10,12-18H,4-6,11,19-20H2,1-3H3,(H,35,36,38,39) | PDB
Reactome pathway
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| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282799
(2-Butyl-6-[3-(4-methyl-furan-2-yl)-4,5-dihydro-iso...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1CC(=NO1)c1cc(C)co1 |c:40| Show InChI InChI=1S/C34H31N7O3/c1-3-4-9-32-35-28-15-14-24(30-18-29(38-44-30)31-16-21(2)20-43-31)17-27(28)34(42)41(32)19-22-10-12-23(13-11-22)25-7-5-6-8-26(25)33-36-39-40-37-33/h5-8,10-17,20,30H,3-4,9,18-19H2,1-2H3,(H,36,37,39,40) | PDB
Reactome pathway
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| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50009714
(CHEMBL191 | {2-Butyl-5-chloro-3-[2'-(2H-tetrazol-5...)Show SMILES CCCCC1=NC(Cl)C(CO)N1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 |t:4| Show InChI InChI=1S/C22H25ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,19,21,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28) | PDB
Reactome pathway
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| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282795
(2-Butyl-6-[3-(4-methyl-thiophen-2-yl)-4,5-dihydro-...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1CC(=NO1)c1cc(C)cs1 |c:40| Show InChI InChI=1S/C34H31N7O2S/c1-3-4-9-32-35-28-15-14-24(30-18-29(38-43-30)31-16-21(2)20-44-31)17-27(28)34(42)41(32)19-22-10-12-23(13-11-22)25-7-5-6-8-26(25)33-36-39-40-37-33/h5-8,10-17,20,30H,3-4,9,18-19H2,1-2H3,(H,36,37,39,40) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Bos taurus) | BDBM50282811
(5-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C1CC(=NO1)C(O)=O |c:40| Show InChI InChI=1S/C30H27N7O4/c1-2-3-8-27-31-24-14-13-20(26-16-25(30(39)40)34-41-26)15-23(24)29(38)37(27)17-18-9-11-19(12-10-18)21-6-4-5-7-22(21)28-32-35-36-33-28/h4-7,9-15,26H,2-3,8,16-17H2,1H3,(H,39,40)(H,32,33,35,36) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro Angiotensin II receptor antagonism in bovine adrenal cortex tissue. |
Bioorg Med Chem Lett 4: 1703-1708 (1994)
Article DOI: 10.1016/S0960-894X(00)80365-0
BindingDB Entry DOI: 10.7270/Q2JS9QB3 |
More data for this
Ligand-Target Pair | |
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