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SMILES: CC12CCC3C(CCC4=CC(=O)CCC34C)C1CC=C2

InChI Key: InChIKey=HNDHDMOSWUAEAW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50422490   
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 3


(Mus musculus)		BDBM50422490
PNG
(CHEMBL141998)
Show SMILES CC12CCC3C(CCC4=CC(=O)CCC34C)C1CC=C2 |c:21,t:8|
Show InChI InChI=1S/C19H26O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,12,15-17H,4-8,10-11H2,1-2H3
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Similars
Article
PubMed
n/an/a 794n/an/an/an/an/an/a



University of Kuopio

Curated by ChEMBL


Assay Description
Inhibitory concentration against mouse constitutive androstane receptor (mCAR) activity was determined as pIC50

J Med Chem 46: 4687-95 (2003)


Article DOI: 10.1021/jm030861t
BindingDB Entry DOI: 10.7270/Q2HX1DFR
More data for this
Ligand-Target Pair