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SMILES: CC(C)OC(=O)C(Cn1ccnc1)NC(=O)c1nc2ccccc2s1

InChI Key: InChIKey=LHRLGGIETKGGNS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50120487   
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
Cytochrome P450 26A1


(Homo sapiens (Human))		BDBM50120487
PNG
(CHEMBL3617991)
Show SMILES CC(C)OC(=O)C(Cn1ccnc1)NC(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C17H18N4O3S/c1-11(2)24-17(23)13(9-21-8-7-18-10-21)19-15(22)16-20-12-5-3-4-6-14(12)25-16/h3-8,10-11,13H,9H2,1-2H3,(H,19,22)
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Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of CYP26A1 in ATRA-induced human HL60 cell microsomes incubated for 30 mins in dark condition with NADPH and ATRA by HPLC method

Bioorg Med Chem 23: 6763-73 (2015)


BindingDB Entry DOI: 10.7270/Q2668G0C
More data for this
Ligand-Target Pair