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BDBM50067624 2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-{3-[(3,4-dimethoxy-benzyl)-methyl-amino]-propyl}-thiazolidin-4-one::CHEMBL138800

SMILES: COc1ccc(CN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1OC

InChI Key: InChIKey=AENYUXFGNVUDBE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50067624   
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)		BDBM50067624
PNG
(2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-{3-[(3,4-...)
Show SMILES COc1ccc(CN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1OC
Show InChI InChI=1S/C30H44N2O4S/c1-29(2,3)22-16-21(17-23(27(22)34)30(4,5)6)28-32(26(33)19-37-28)14-10-13-31(7)18-20-11-12-24(35-8)25(15-20)36-9/h11-12,15-17,28,34H,10,13-14,18-19H2,1-9H3
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PC sid
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Article
PubMed
n/an/a 120n/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