Found 41 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 B
(RAT) | BDBM50009718
(2-Ethyl-5,7-dimethyl-3-[2'-(1H-tetrazol-5-yl)-biph...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C24H23N7/c1-4-21-26-22-15(2)13-16(3)25-24(22)31(21)14-17-9-11-18(12-10-17)19-7-5-6-8-20(19)23-27-29-30-28-23/h5-13H,4,14H2,1-3H3,(H,27,28,29,30) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50009712
(5,7-Dimethyl-2-propyl-3-[2'-(2H-tetrazol-5-yl)-bip...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C25H25N7/c1-4-7-22-27-23-16(2)14-17(3)26-25(23)32(22)15-18-10-12-19(13-11-18)20-8-5-6-9-21(20)24-28-30-31-29-24/h5-6,8-14H,4,7,15H2,1-3H3,(H,28,29,30,31) | PDB
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| n/a | n/a | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50009719
(7-Methyl-2-propyl-3-[2'-(2H-tetrazol-5-yl)-bipheny...)Show SMILES CCCc1nc2c(C)ccnc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C24H23N7/c1-3-6-21-26-22-16(2)13-14-25-24(22)31(21)15-17-9-11-18(12-10-17)19-7-4-5-8-20(19)23-27-29-30-28-23/h4-5,7-14H,3,6,15H2,1-2H3,(H,27,28,29,30) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50049186
((S)-3-Methyl-2-{pentanoyl-[2'-(1H-tetrazol-5-yl)-b...)Show SMILES CCCCC(=O)N(Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@@H](C(C)C)C(O)=O Show InChI InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1 | PDB
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| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145961
(7-Methyl-2-propyl-3-{4-[3-(2H-tetrazol-5-yl)-pyrid...)Show SMILES CCCc1nc2c(C)ccnc2n1Cc1ccc(cc1)-c1ccncc1-c1nnn[nH]1 Show InChI InChI=1S/C23H22N8/c1-3-4-20-26-21-15(2)9-12-25-23(21)31(20)14-16-5-7-17(8-6-16)18-10-11-24-13-19(18)22-27-29-30-28-22/h5-13H,3-4,14H2,1-2H3,(H,27,28,29,30) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145972
(2-Amino-4-[4-(5,7-dimethyl-2-propyl-imidazo[4,5-b]...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(N)nc2ccccc12 Show InChI InChI=1S/C28H27N5O2/c1-4-7-22-32-25-16(2)14-17(3)30-27(25)33(22)15-18-10-12-19(13-11-18)23-20-8-5-6-9-21(20)31-26(29)24(23)28(34)35/h5-6,8-14H,4,7,15H2,1-3H3,(H2,29,31)(H,34,35) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50046078
(5-[4'-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-biph...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cc2)-c2ccccc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C24H29N7/c1-3-5-11-22-25-23(12-6-4-2)31(28-22)17-18-13-15-19(16-14-18)20-9-7-8-10-21(20)24-26-29-30-27-24/h7-10,13-16H,3-6,11-12,17H2,1-2H3,(H,26,27,29,30) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(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
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| n/a | n/a | 6.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145967
(2-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-5-[2-(1H...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cn2)-c2ccccc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-11-21-25-22(12-6-4-2)31(28-21)16-18-14-13-17(15-24-18)19-9-7-8-10-20(19)23-26-29-30-27-23/h7-10,13-15H,3-6,11-12,16H2,1-2H3,(H,26,27,29,30) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50049209
(5-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-2-[2-(1H...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(nc2)-c2ccccc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-11-21-25-22(12-6-4-2)31(28-21)16-17-13-14-20(24-15-17)18-9-7-8-10-19(18)23-26-29-30-27-23/h7-10,13-15H,3-6,11-12,16H2,1-2H3,(H,26,27,29,30) | PDB
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| n/a | n/a | 6.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145979
(4-(4-((2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyrid...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)-c1nnn[nH]1 Show InChI InChI=1S/C27H24N8/c1-4-23-30-25-16(2)13-17(3)29-27(25)35(23)15-18-9-11-19(12-10-18)24-20-7-5-6-8-22(20)28-14-21(24)26-31-33-34-32-26/h5-14H,4,15H2,1-3H3,(H,31,32,33,34) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145977
(2-Chloro-4-[4-(5,7-dimethyl-2-propyl-imidazo[4,5-b...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(Cl)nc2ccccc12 Show InChI InChI=1S/C28H25ClN4O2/c1-4-7-22-32-25-16(2)14-17(3)30-27(25)33(22)15-18-10-12-19(13-11-18)23-20-8-5-6-9-21(20)31-26(29)24(23)28(34)35/h5-6,8-14H,4,7,15H2,1-3H3,(H,34,35) | PDB
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| n/a | n/a | 7.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145981
(4-(4-((5,7-dimethyl-2-propyl-3H-imidazo[4,5-b]pyri...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(C)nc2ccccc12 Show InChI InChI=1S/C29H28N4O2/c1-5-8-24-32-27-17(2)15-18(3)30-28(27)33(24)16-20-11-13-21(14-12-20)26-22-9-6-7-10-23(22)31-19(4)25(26)29(34)35/h6-7,9-15H,5,8,16H2,1-4H3,(H,34,35) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145987
(4'-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-y...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O Show InChI InChI=1S/C24H23N3O2/c1-4-21-26-22-15(2)13-16(3)25-23(22)27(21)14-17-9-11-18(12-10-17)19-7-5-6-8-20(19)24(28)29/h5-13H,4,14H2,1-3H3,(H,28,29) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145973
(4-[4-(5,7-Dimethyl-2-propyl-imidazo[4,5-b]pyridin-...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)C(O)=O Show InChI InChI=1S/C28H26N4O2/c1-4-7-24-31-26-17(2)14-18(3)30-27(26)32(24)16-19-10-12-20(13-11-19)25-21-8-5-6-9-23(21)29-15-22(25)28(33)34/h5-6,8-15H,4,7,16H2,1-3H3,(H,33,34) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145986
(4-[4-(5,7-Dimethyl-2-propyl-imidazo[4,5-b]pyridin-...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)-c1nnn[nH]1 Show InChI InChI=1S/C28H26N8/c1-4-7-24-31-26-17(2)14-18(3)30-28(26)36(24)16-19-10-12-20(13-11-19)25-21-8-5-6-9-23(21)29-15-22(25)27-32-34-35-33-27/h5-6,8-15H,4,7,16H2,1-3H3,(H,32,33,34,35) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145976
(2-Amino-4-[4-(2-butyl-5,7-dimethyl-imidazo[4,5-b]p...)Show SMILES CCCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(N)nc2ccccc12 Show InChI InChI=1S/C29H29N5O2/c1-4-5-10-23-33-26-17(2)15-18(3)31-28(26)34(23)16-19-11-13-20(14-12-19)24-21-8-6-7-9-22(21)32-27(30)25(24)29(35)36/h6-9,11-15H,4-5,10,16H2,1-3H3,(H2,30,32)(H,35,36) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145964
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(NC)nc2ccccc12 Show InChI InChI=1S/C28H27N5O2/c1-5-22-32-25-16(2)14-17(3)30-27(25)33(22)15-18-10-12-19(13-11-18)23-20-8-6-7-9-21(20)31-26(29-4)24(23)28(34)35/h6-14H,5,15H2,1-4H3,(H,29,31)(H,34,35) | PDB
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Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145971
(2-Amino-4-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]p...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(N)nc2ccccc12 Show InChI InChI=1S/C27H25N5O2/c1-4-21-31-24-15(2)13-16(3)29-26(24)32(21)14-17-9-11-18(12-10-17)22-19-7-5-6-8-20(19)30-25(28)23(22)27(33)34/h5-13H,4,14H2,1-3H3,(H2,28,30)(H,33,34) | PDB
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| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145988
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)C(O)=O Show InChI InChI=1S/C27H24N4O2/c1-4-23-30-25-16(2)13-17(3)29-26(25)31(23)15-18-9-11-19(12-10-18)24-20-7-5-6-8-22(20)28-14-21(24)27(32)33/h5-14H,4,15H2,1-3H3,(H,32,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145960
(2-Ethyl-5,7-dimethyl-3-{4-[3-(2H-tetrazol-5-yl)-py...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1ncccc1-c1nnn[nH]1 Show InChI InChI=1S/C23H22N8/c1-4-19-26-20-14(2)12-15(3)25-23(20)31(19)13-16-7-9-17(10-8-16)21-18(6-5-11-24-21)22-27-29-30-28-22/h5-12H,4,13H2,1-3H3,(H,27,28,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145970
(2-Dimethylamino-4-[4-(2-ethyl-5,7-dimethyl-imidazo...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(nc2ccccc12)N(C)C Show InChI InChI=1S/C29H29N5O2/c1-6-23-32-26-17(2)15-18(3)30-28(26)34(23)16-19-11-13-20(14-12-19)24-21-9-7-8-10-22(21)31-27(33(4)5)25(24)29(35)36/h7-15H,6,16H2,1-5H3,(H,35,36) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145968
(1-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(ccc2ccccc12)C(O)=O Show InChI InChI=1S/C28H25N3O2/c1-4-24-30-26-17(2)15-18(3)29-27(26)31(24)16-19-9-11-21(12-10-19)25-22-8-6-5-7-20(22)13-14-23(25)28(32)33/h5-15H,4,16H2,1-3H3,(H,32,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145969
(4-[4-(2-Butyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)C(O)=O Show InChI InChI=1S/C29H28N4O2/c1-4-5-10-25-32-27-18(2)15-19(3)31-28(27)33(25)17-20-11-13-21(14-12-20)26-22-8-6-7-9-24(22)30-16-23(26)29(34)35/h6-9,11-16H,4-5,10,17H2,1-3H3,(H,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145993
(5-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c2nnnn2c2ccccc12 Show InChI InChI=1S/C27H23N7O2/c1-4-21-29-24-15(2)13-16(3)28-26(24)33(21)14-17-9-11-18(12-10-17)22-19-7-5-6-8-20(19)34-25(30-31-32-34)23(22)27(35)36/h5-13H,4,14H2,1-3H3,(H,35,36) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145974
(7-Methyl-2-propyl-3-{4-[2-(2H-tetrazol-5-yl)-pyrid...)Show SMILES CCCc1nc2c(C)ccnc2n1Cc1ccc(cc1)-c1cccnc1-c1nnn[nH]1 Show InChI InChI=1S/C23H22N8/c1-3-5-19-26-20-15(2)11-13-25-23(20)31(19)14-16-7-9-17(10-8-16)18-6-4-12-24-21(18)22-27-29-30-28-22/h4,6-13H,3,5,14H2,1-2H3,(H,27,28,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145978
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCCNc1nc2ccccc2c(-c2ccc(Cn3c(CC)nc4c(C)cc(C)nc34)cc2)c1C(O)=O Show InChI InChI=1S/C30H31N5O2/c1-5-15-31-28-26(30(36)37)25(22-9-7-8-10-23(22)33-28)21-13-11-20(12-14-21)17-35-24(6-2)34-27-18(3)16-19(4)32-29(27)35/h7-14,16H,5-6,15,17H2,1-4H3,(H,31,33)(H,36,37) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 66 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145990
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(OC)nc2ccccc12 Show InChI InChI=1S/C28H26N4O3/c1-5-22-31-25-16(2)14-17(3)29-26(25)32(22)15-18-10-12-19(13-11-18)23-20-8-6-7-9-21(20)30-27(35-4)24(23)28(33)34/h6-14H,5,15H2,1-4H3,(H,33,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 74 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145992
(2-[4-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-pheny...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cc2)-c2ncccc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-9-20-25-21(10-6-4-2)31(28-20)16-17-11-13-18(14-12-17)22-19(8-7-15-24-22)23-26-29-30-27-23/h7-8,11-15H,3-6,9-10,16H2,1-2H3,(H,26,27,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145983
(CHEMBL83414 | N-{4-[4-(5,7-Dimethyl-2-propyl-imida...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)C(=O)NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C34H30N6O5S/c1-4-7-30-37-32-21(2)18-22(3)36-33(32)39(30)20-23-10-12-24(13-11-23)31-27-8-5-6-9-29(27)35-19-28(31)34(41)38-46(44,45)26-16-14-25(15-17-26)40(42)43/h5-6,8-19H,4,7,20H2,1-3H3,(H,38,41) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 106 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145982
(3-[4-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-pheny...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cc2)-c2cccnc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-9-20-25-21(10-6-4-2)31(28-20)16-17-11-13-18(14-12-17)19-8-7-15-24-22(19)23-26-29-30-27-23/h7-8,11-15H,3-6,9-10,16H2,1-2H3,(H,26,27,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145985
(7-Methyl-2-propyl-3-{4-[3-(2H-tetrazol-5-yl)-pyrid...)Show SMILES CCCc1nc2c(C)ccnc2n1Cc1ccc(cc1)-c1ncccc1-c1nnn[nH]1 Show InChI InChI=1S/C23H22N8/c1-3-5-19-26-20-15(2)11-13-25-23(20)31(19)14-16-7-9-17(10-8-16)21-18(6-4-12-24-21)22-27-29-30-28-22/h4,6-13H,3,5,14H2,1-2H3,(H,27,28,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 116 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145980
(3-[4-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-pheny...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cc2)-c2cnccc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-7-21-25-22(8-6-4-2)31(28-21)16-17-9-11-18(12-10-17)20-15-24-14-13-19(20)23-26-29-30-27-23/h9-15H,3-8,16H2,1-2H3,(H,26,27,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145984
(CHEMBL437659 | {2-Chloro-4-[4-(2-ethyl-5,7-dimethy...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(CC(O)=O)c(Cl)nc2ccccc12 Show InChI InChI=1S/C28H25ClN4O2/c1-4-23-32-26-16(2)13-17(3)30-28(26)33(23)15-18-9-11-19(12-10-18)25-20-7-5-6-8-22(20)31-27(29)21(25)14-24(34)35/h5-13H,4,14-15H2,1-3H3,(H,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 215 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145991
(4-[4-(3,5-Dibutyl-[1,2,4]triazol-1-ylmethyl)-pheny...)Show SMILES CCCCc1nc(CCCC)n(Cc2ccc(cc2)-c2ccncc2-c2nnn[nH]2)n1 Show InChI InChI=1S/C23H28N8/c1-3-5-7-21-25-22(8-6-4-2)31(28-21)16-17-9-11-18(12-10-17)19-13-14-24-15-20(19)23-26-29-30-27-23/h9-15H,3-8,16H2,1-2H3,(H,26,27,29,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145963
(4-[4-(5,7-Dimethyl-2-propyl-imidazo[4,5-b]pyridin-...)Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(=O)[nH]c2ccccc12 Show InChI InChI=1S/C28H26N4O3/c1-4-7-22-31-25-16(2)14-17(3)29-26(25)32(22)15-18-10-12-19(13-11-18)23-20-8-5-6-9-21(20)30-27(33)24(23)28(34)35/h5-6,8-14H,4,7,15H2,1-3H3,(H,30,33)(H,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 261 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145959
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)C1=C2C=CC=CC2N(C)C(=O)C1c1nnn[nH]1 |c:23,25,27| Show InChI InChI=1S/C28H28N8O/c1-5-22-30-25-16(2)14-17(3)29-27(25)36(22)15-18-10-12-19(13-11-18)23-20-8-6-7-9-21(20)35(4)28(37)24(23)26-31-33-34-32-26/h6-14,21,24H,5,15H2,1-4H3,(H,31,32,33,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >300 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145966
(4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)C1=C2C=CC=CC2N(C)C(=O)C1C(O)=O |c:23,25,27| Show InChI InChI=1S/C28H28N4O3/c1-5-22-30-25-16(2)14-17(3)29-26(25)32(22)15-18-10-12-19(13-11-18)23-20-8-6-7-9-21(20)31(4)27(33)24(23)28(34)35/h6-14,21,24H,5,15H2,1-4H3,(H,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 326 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145962
(2-Dipropylamino-4-[4-(2-ethyl-5,7-dimethyl-imidazo...)Show SMILES CCCN(CCC)c1nc2ccccc2c(-c2ccc(Cn3c(CC)nc4c(C)cc(C)nc34)cc2)c1C(O)=O Show InChI InChI=1S/C33H37N5O2/c1-6-17-37(18-7-2)31-29(33(39)40)28(25-11-9-10-12-26(25)35-31)24-15-13-23(14-16-24)20-38-27(8-3)36-30-21(4)19-22(5)34-32(30)38/h9-16,19H,6-8,17-18,20H2,1-5H3,(H,39,40) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 492 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145965
(CHEMBL313718 | {4-[4-(2-Ethyl-5,7-dimethyl-imidazo...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(CC(O)=O)cnc2ccccc12 Show InChI InChI=1S/C28H26N4O2/c1-4-24-31-27-17(2)13-18(3)30-28(27)32(24)16-19-9-11-20(12-10-19)26-21(14-25(33)34)15-29-23-8-6-5-7-22(23)26/h5-13,15H,4,14,16H2,1-3H3,(H,33,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 576 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor B
(RAT) | BDBM50145975
(2-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1ncccc1C(O)=O Show InChI InChI=1S/C23H22N4O2/c1-4-19-26-20-14(2)12-15(3)25-22(20)27(19)13-16-7-9-17(10-8-16)21-18(23(28)29)6-5-11-24-21/h5-12H,4,13H2,1-3H3,(H,28,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 819 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Siena
Curated by ChEMBL
| Assay Description
Binding affinity for rat angiotensin II receptor, type 1 |
J Med Chem 47: 2574-86 (2004)
Article DOI: 10.1021/jm031100t
BindingDB Entry DOI: 10.7270/Q25X28DX |
More data for this
Ligand-Target Pair | |
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