Found 23 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 |
|---|
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169823
((+)-6-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridi...)Show SMILES COC(=O)C1CC=CCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:6| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-4,7-10,12,14,19-20H,5-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 0.830 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169823
((+)-6-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridi...)Show SMILES COC(=O)C1CC=CCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:6| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-4,7-10,12,14,19-20H,5-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 0.830 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169823
((+)-6-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridi...)Show SMILES COC(=O)C1CC=CCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:6| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-4,7-10,12,14,19-20H,5-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169834
(2-Cyano-N-(4-methyl-2-{4-[(1S,6S)-6-(3-methyl-[1,2...)Show SMILES Cc1noc(n1)[C@H]1CC=CC[C@@H]1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:9| Show InChI InChI=1S/C25H26N6O2/c1-16-12-14-27-24(23(16)30-22(32)11-13-26)28-15-18-7-9-19(10-8-18)20-5-3-4-6-21(20)25-29-17(2)31-33-25/h3-4,7-10,12,14,20-21H,5-6,11,15H2,1-2H3,(H,27,28)(H,30,32)/t20-,21+/m1/s1 | PDB
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| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169819
((+/-trans)-2-(4-{[3-(2-Cyano-acetylamino)-4-methyl...)Show SMILES COC(=O)C1CCCCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C24H28N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h7-10,12,14,19-20H,3-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169823
((+)-6-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridi...)Show SMILES COC(=O)C1CC=CCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:6| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-4,7-10,12,14,19-20H,5-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169825
(4'-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-yl...)Show SMILES COC(=O)c1ccccc1-c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C24H22N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-10,12,14H,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169831
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1N1CCC(CNc2nccc(C)c2NC(=O)CC#N)CC1 Show InChI InChI=1S/C23H27N5O3/c1-16-8-12-25-22(21(16)27-20(29)7-11-24)26-15-17-9-13-28(14-10-17)19-6-4-3-5-18(19)23(30)31-2/h3-6,8,12,17H,7,9-10,13-15H2,1-2H3,(H,25,26)(H,27,29) | PDB
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| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169827
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1C1=CCC(CNc2nccc(C)c2NC(=O)CC#N)CC1 |t:11| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-6,9,12,14,17H,7-8,10-11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169828
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |t:4| Show InChI InChI=1S/C24H26N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h7-10,12,14H,3-6,11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169820
((+/-trans endo)-3-(4-{[3-(2-Cyano-acetylamino)-4-m...)Show SMILES COC(=O)C1C2CCC(C=C2)C1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:9| Show InChI InChI=1S/C26H28N4O3/c1-16-12-14-28-25(24(16)30-21(31)11-13-27)29-15-17-3-5-18(6-4-17)22-19-7-9-20(10-8-19)23(22)26(32)33-2/h3-7,9,12,14,19-20,22-23H,8,10-11,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
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| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169820
((+/-trans endo)-3-(4-{[3-(2-Cyano-acetylamino)-4-m...)Show SMILES COC(=O)C1C2CCC(C=C2)C1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |c:9| Show InChI InChI=1S/C26H28N4O3/c1-16-12-14-28-25(24(16)30-21(31)11-13-27)29-15-17-3-5-18(6-4-17)22-19-7-9-20(10-8-19)23(22)26(32)33-2/h3-7,9,12,14,19-20,22-23H,8,10-11,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
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| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169836
(3-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1C2CCC(CC2)C1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |(28.94,-1.68,;27.46,-1.28,;26.13,-2.07,;24.78,-1.3,;26.13,-3.61,;27.47,-4.38,;25.99,-4.78,;26.29,-5.51,;24.81,-5.92,;26.13,-6.68,;27.46,-5.91,;24.81,-4.38,;23.48,-3.61,;22.13,-4.38,;20.8,-3.61,;20.81,-2.07,;19.32,-1.67,;19.32,-.12,;17.83,.27,;16.49,-.5,;15.17,.27,;15.17,1.81,;16.49,2.6,;16.48,4.13,;17.83,1.83,;19.17,2.6,;19.15,4.14,;17.82,4.92,;20.49,4.92,;21.83,4.16,;23.15,3.39,;22.13,-1.29,;23.47,-2.06,)| Show InChI InChI=1S/C26H30N4O3/c1-16-12-14-28-25(24(16)30-21(31)11-13-27)29-15-17-3-5-18(6-4-17)22-19-7-9-20(10-8-19)23(22)26(32)33-2/h3-6,12,14,19-20,22-23H,7-11,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
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| 54 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169833
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1=C(CCC1)c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 |t:4| Show InChI InChI=1S/C23H24N4O3/c1-15-11-13-25-22(21(15)27-20(28)10-12-24)26-14-16-6-8-17(9-7-16)18-4-3-5-19(18)23(29)30-2/h6-9,11,13H,3-5,10,14H2,1-2H3,(H,25,26)(H,27,28) | PDB
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| 126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169829
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1N1CCC(CNc2nccc(C)c2NC(=O)CC#N)=CC1 |c:30| Show InChI InChI=1S/C23H25N5O3/c1-16-8-12-25-22(21(16)27-20(29)7-11-24)26-15-17-9-13-28(14-10-17)19-6-4-3-5-18(19)23(30)31-2/h3-6,8-9,12H,7,10,13-15H2,1-2H3,(H,25,26)(H,27,29) | PDB
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| 130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169824
(1-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1cccn1-c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C22H21N5O3/c1-15-10-12-24-21(20(15)26-19(28)9-11-23)25-14-16-5-7-17(8-6-16)27-13-3-4-18(27)22(29)30-2/h3-8,10,12-13H,9,14H2,1-2H3,(H,24,25)(H,26,28) | PDB
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| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169835
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1C1CCC(CNc2nccc(C)c2NC(=O)CC#N)CC1 |(6.75,-7.03,;5.67,-5.93,;4.32,-6.7,;2.99,-5.93,;4.32,-8.24,;5.67,-9.01,;5.67,-10.55,;4.32,-11.32,;3.01,-10.55,;3.01,-9.01,;1.68,-8.24,;.33,-9.01,;-1,-8.24,;-1,-6.7,;-2.3,-5.93,;-2.3,-4.39,;-3.64,-3.62,;-4.97,-4.39,;-6.32,-3.62,;-6.32,-2.08,;-4.97,-1.31,;-4.99,.23,;-3.64,-2.08,;-2.3,-1.31,;-2.31,.25,;-3.68,1,;-1,1.02,;.35,.26,;1.69,-.5,;.33,-5.93,;1.66,-6.7,)| Show InChI InChI=1S/C24H28N4O3/c1-16-12-14-26-23(22(16)28-21(29)11-13-25)27-15-17-7-9-18(10-8-17)19-5-3-4-6-20(19)24(30)31-2/h3-6,12,14,17-18H,7-11,15H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| 385 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169821
(3-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1C2CCC(C2)C1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C25H28N4O3/c1-15-10-12-27-24(23(15)29-20(30)9-11-26)28-14-16-3-5-17(6-4-16)21-18-7-8-19(13-18)22(21)25(31)32-2/h3-6,10,12,18-19,21-22H,7-9,13-14H2,1-2H3,(H,27,28)(H,29,30) | PDB
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| 730 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169837
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1N1CCC(C)(CNc2nccc(C)c2NC(=O)CC#N)CC1 Show InChI InChI=1S/C24H29N5O3/c1-17-9-13-26-22(21(17)28-20(30)8-12-25)27-16-24(2)10-14-29(15-11-24)19-7-5-4-6-18(19)23(31)32-3/h4-7,9,13H,8,10-11,14-16H2,1-3H3,(H,26,27)(H,28,30) | PDB
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| 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169826
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)N1CCCCC1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C23H27N5O3/c1-16-11-13-25-22(21(16)27-20(29)10-12-24)26-15-17-6-8-18(9-7-17)19-5-3-4-14-28(19)23(30)31-2/h6-9,11,13,19H,3-5,10,14-15H2,1-2H3,(H,25,26)(H,27,29) | PDB
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| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169830
(2-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)c1ccccc1N1CCC(O)(CNc2nccc(C)c2NC(=O)CC#N)CC1 Show InChI InChI=1S/C23H27N5O4/c1-16-8-12-25-21(20(16)27-19(29)7-11-24)26-15-23(31)9-13-28(14-10-23)18-6-4-3-5-17(18)22(30)32-2/h3-6,8,12,31H,7,9-10,13-15H2,1-2H3,(H,25,26)(H,27,29) | PDB
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| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169822
(1-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1CCCCN1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C23H27N5O3/c1-16-11-13-25-22(21(16)27-20(29)10-12-24)26-15-17-6-8-18(9-7-17)28-14-4-3-5-19(28)23(30)31-2/h6-9,11,13,19H,3-5,10,14-15H2,1-2H3,(H,25,26)(H,27,29) | PDB
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| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
B1 bradykinin receptor
(Homo sapiens (Human)) | BDBM50169832
(1-(4-{[3-(2-Cyano-acetylamino)-4-methyl-pyridin-2-...)Show SMILES COC(=O)C1CCCN1c1ccc(CNc2nccc(C)c2NC(=O)CC#N)cc1 Show InChI InChI=1S/C22H25N5O3/c1-15-10-12-24-21(20(15)26-19(28)9-11-23)25-14-16-5-7-17(8-6-16)27-13-3-4-18(27)22(29)30-2/h5-8,10,12,18H,3-4,9,13-14H2,1-2H3,(H,24,25)(H,26,28) | PDB
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| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck
Curated by ChEMBL
| Assay Description
Binding affinity against Human bradykinin receptor B1 |
Bioorg Med Chem Lett 15: 3925-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.133
BindingDB Entry DOI: 10.7270/Q2NC60Q0 |
More data for this
Ligand-Target Pair | |
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