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PubMed code 2552119

Compile data set for download or QSAR
Found 6 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
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50103634
PNG
(CL-287389 | FK-235 | NILVADIPINE | Nilvadipine | N...)
Show SMILES COC(=O)C1=C(NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C)C#N
Show InChI InChI=1S/C19H19N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h5-8,10,16,21H,1-4H3
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PubMed
n/an/a 1n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50227967
PNG
(CHEMBL78973)
Show SMILES CC(C)OC(=O)C1=C(C)N=C(C)N(C1c1ccccc1[N+]([O-])=O)C(=O)OCCN(Cc1ccccc1)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C33H34Cl2N4O6/c1-21(2)45-32(40)30-22(3)36-23(4)38(31(30)26-12-8-9-13-29(26)39(42)43)33(41)44-17-16-37(19-24-10-6-5-7-11-24)20-25-14-15-27(34)28(35)18-25/h5-15,18,21,31H,16-17,19-20H2,1-4H3
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PC sid
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Article
PubMed
n/an/a 2.10n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]- Nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50101817
PNG
(Adalat | Adalat Cc | Afeditab Cr | BAY-A-1040 | CH...)
Show SMILES COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OC
Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3
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KEGG
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PubMed
n/an/a 2.5n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50101815
PNG
(CHEBI:7550 | NICARDIPINE | Nicardipine)
Show SMILES COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCCN(C)Cc1ccccc1
Show InChI InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3
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PubMed
n/an/a 2.70n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50227968
PNG
(CHEMBL310953)
Show SMILES CC(C)OC(=O)C1=C(C)N=C(C)N(C1c1ccccc1[N+]([O-])=O)C(=O)OCCN(Cc1ccccc1)Cc1ccc2ccccc2c1
Show InChI InChI=1S/C37H38N4O6/c1-25(2)47-36(42)34-26(3)38-27(4)40(35(34)32-16-10-11-17-33(32)41(44)45)37(43)46-21-20-39(23-28-12-6-5-7-13-28)24-29-18-19-30-14-8-9-15-31(30)22-29/h5-19,22,25,35H,20-21,23-24H2,1-4H3
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PC cid
PC sid
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Article
PubMed
n/an/a 7.10n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]- Nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50227969
PNG
(CHEMBL312176 | CV-4093)
Show SMILES CO\C(O)=C1/C(C(C(=O)OCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C35H38N4O6/c1-24-30(34(40)44-3)32(28-15-10-16-29(23-28)39(42)43)31(25(2)36-24)35(41)45-22-21-37-17-19-38(20-18-37)33(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-16,23,32-33,40H,17-22H2,1-3H3/b34-30-
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.70n/an/an/an/an/an/a



Suntory Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]- Nitrendipine binding to L-type calcium channels of rat cerebral cortex


J Med Chem 32: 2399-406 (1989)


Article DOI: 10.1021/jm00130a029
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%