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BDBM50067637 2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-(3-{[2-(4-methoxy-phenoxy)-ethyl]-methyl-amino}-propyl)-thiazolidin-4-one::CHEMBL137172

SMILES: COc1ccc(OCCN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1

InChI Key: InChIKey=YMJMLBOAWZAJFV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50067637   
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
Calcium channel


(RAT)		BDBM50067637
PNG
(2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-(3-{[2-(4...)
Show SMILES COc1ccc(OCCN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1
Show InChI InChI=1S/C30H44N2O4S/c1-29(2,3)24-18-21(19-25(27(24)34)30(4,5)6)28-32(26(33)20-37-28)15-9-14-31(7)16-17-36-23-12-10-22(35-8)11-13-23/h10-13,18-19,28,34H,9,14-17,20H2,1-8H3
PDB

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PC sid
UniChem

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Article
PubMed
n/an/a 230n/an/an/an/an/an/a



Chugai Pharmaceutical Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of K+ induced contractions of the isolated rat aorta.

J Med Chem 41: 4309-16 (1998)


Article DOI: 10.1021/jm980335f
BindingDB Entry DOI: 10.7270/Q23N22JV
More data for this
Ligand-Target Pair