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BDBM50229245 CHEMBL2115150

SMILES: CCOC(=O)C1=C(C[S+]([O-])c2ccccc2)NC(C)=C(C#N)C1c1ccccc1C(F)(F)F

InChI Key: InChIKey=VDGKOGKAKKJACD-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50229245   
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-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50229245
PNG
(CHEMBL2115150)
Show SMILES CCOC(=O)C1=C(C[S+]([O-])c2ccccc2)NC(C)=C(C#N)C1c1ccccc1C(F)(F)F
Show InChI InChI=1S/C24H21F3N2O3S/c1-3-32-23(30)22-20(14-33(31)16-9-5-4-6-10-16)29-15(2)18(13-28)21(22)17-11-7-8-12-19(17)24(25,26)27/h4-12,21,29H,3,14H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity to bind dihydropyridine receptor (DHP receptor) by inhibiting the radioligand [3H]nitrendipine


J Med Chem 34: 2248-60 (1991)


Article DOI: 10.1021/jm00111a047
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50229245
PNG
(CHEMBL2115150)
Show SMILES CCOC(=O)C1=C(C[S+]([O-])c2ccccc2)NC(C)=C(C#N)C1c1ccccc1C(F)(F)F
Show InChI InChI=1S/C24H21F3N2O3S/c1-3-32-23(30)22-20(14-33(31)16-9-5-4-6-10-16)29-15(2)18(13-28)21(22)17-11-7-8-12-19(17)24(25,26)27/h4-12,21,29H,3,14H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.80E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity to bind dihydropyridine receptor (DHP receptor) by inhibiting the radioligand [3H]nitrendipine


J Med Chem 34: 2248-60 (1991)


Article DOI: 10.1021/jm00111a047
More data for this
Ligand-Target Pair