Found 5 hits Enz. Inhib. hit(s) with all data for entry = 50004541 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 |
|---|
Voltage-dependent L-type calcium channel subunit alpha-1S
(Rattus norvegicus) | BDBM50101813
(CHEBI:31399 | Cilnidipine)Show SMILES COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC\C=C\c1ccccc1 |c:7,12| Show InChI InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| Purchase
DrugBank
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Pharmaceuticals Co., Ltd
Curated by ChEMBL
| Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring |
Bioorg Med Chem Lett 21: 3317-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ |
More data for this
Ligand-Target Pair | |
Voltage-dependent L-type calcium channel subunit alpha-1S
(Rattus norvegicus) | BDBM50475659
(CHEMBL508181)Show SMILES CC1=C(C(C(C(=O)OC\C=C\c2ccccc2)=C(C)N1)c1cccc(c1)[N+]([O-])=O)C(O)=O |t:1,17| Show InChI InChI=1S/C24H22N2O6/c1-15-20(23(27)28)22(18-11-6-12-19(14-18)26(30)31)21(16(2)25-15)24(29)32-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,25H,13H2,1-2H3,(H,27,28)/b10-7+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Pharmaceuticals Co., Ltd
Curated by ChEMBL
| Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring |
Bioorg Med Chem Lett 21: 3317-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ |
More data for this
Ligand-Target Pair | |
Voltage-dependent L-type calcium channel subunit alpha-1S
(Rattus norvegicus) | BDBM50383772
(CHEMBL451812)Show SMILES COC(OC)C1=C(C(C(C(O)=O)C(C)=N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:13,t:5| Show InChI InChI=1S/C26H26ClNO6/c1-16-20(24(29)30)21(18-12-7-13-19(27)15-18)22(23(28-16)26(32-2)33-3)25(31)34-14-8-11-17-9-5-4-6-10-17/h4-13,15,20-21,26H,14H2,1-3H3,(H,29,30)/b11-8+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Pharmaceuticals Co., Ltd
Curated by ChEMBL
| Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring |
Bioorg Med Chem Lett 21: 3317-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ |
More data for this
Ligand-Target Pair | |
Voltage-dependent L-type calcium channel subunit alpha-1S
(Rattus norvegicus) | BDBM50383772
(CHEMBL451812)Show SMILES COC(OC)C1=C(C(C(C(O)=O)C(C)=N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:13,t:5| Show InChI InChI=1S/C26H26ClNO6/c1-16-20(24(29)30)21(18-12-7-13-19(27)15-18)22(23(28-16)26(32-2)33-3)25(31)34-14-8-11-17-9-5-4-6-10-17/h4-13,15,20-21,26H,14H2,1-3H3,(H,29,30)/b11-8+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Pharmaceuticals Co., Ltd
Curated by ChEMBL
| Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring |
Bioorg Med Chem Lett 21: 3317-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ |
More data for this
Ligand-Target Pair | |
Voltage-dependent L-type calcium channel subunit alpha-1S
(Rattus norvegicus) | BDBM50383772
(CHEMBL451812)Show SMILES COC(OC)C1=C(C(C(C(O)=O)C(C)=N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:13,t:5| Show InChI InChI=1S/C26H26ClNO6/c1-16-20(24(29)30)21(18-12-7-13-19(27)15-18)22(23(28-16)26(32-2)33-3)25(31)34-14-8-11-17-9-5-4-6-10-17/h4-13,15,20-21,26H,14H2,1-3H3,(H,29,30)/b11-8+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.32E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Pharmaceuticals Co., Ltd
Curated by ChEMBL
| Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring |
Bioorg Med Chem Lett 21: 3317-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ |
More data for this
Ligand-Target Pair | |
Search and Browse
