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SMILES: Cc1cc(no1)-c1onc(C)c1C(=O)Sc1ccc(C)cc1

InChI Key: InChIKey=KYDUJTWWFCHEAT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50018938   
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
Nuclear receptor subfamily 1 group I member 2


(Homo sapiens (Human))		BDBM50018938
PNG
(CHEMBL1445606)
Show SMILES Cc1cc(no1)-c1onc(C)c1C(=O)Sc1ccc(C)cc1
Show InChI InChI=1S/C16H14N2O3S/c1-9-4-6-12(7-5-9)22-16(19)14-11(3)17-21-15(14)13-8-10(2)20-18-13/h4-8H,1-3H3
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Article
PubMed
n/an/a 850n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Antagonist activity at PXR (unknown origin) transfected in human HepG2 cells assessed as inhibition of rifampicin-induced reporter gene transcription

J Med Chem 57: 4819-33 (2014)


Article DOI: 10.1021/jm500351m
BindingDB Entry DOI: 10.7270/Q2XD137W
More data for this
Ligand-Target Pair