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BDBM50000346 Acetic acid 4-(4-methoxy-phenyl)-1-[2-(methyl-propyl-amino)-ethyl]-2-oxo-6-trifluoromethyl-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl ester::CHEMBL165444

SMILES: CCCN(C)CCN1c2cccc(c2C[C@H]([C@@H](OC(C)=O)C1=O)c1ccc(OC)cc1)C(F)(F)F

InChI Key: InChIKey=ZXQCDCRQPKJQFT-GBXCKJPGSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50000346   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000346
PNG
(Acetic acid 4-(4-methoxy-phenyl)-1-[2-(methyl-prop...)
Show SMILES CCCN(C)CCN1c2cccc(c2C[C@H]([C@@H](OC(C)=O)C1=O)c1ccc(OC)cc1)C(F)(F)F
Show InChI InChI=1S/C26H31F3N2O4/c1-5-13-30(3)14-15-31-23-8-6-7-22(26(27,28)29)21(23)16-20(24(25(31)33)35-17(2)32)18-9-11-19(34-4)12-10-18/h6-12,20,24H,5,13-16H2,1-4H3/t20-,24+/m0/s1
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Similars

Article
PubMed
n/an/an/a 520n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair