BDBM50120455 CHEMBL3617993

SMILES: CC(C(c1ccc(Nc2nc3ccccc3s2)cc1)n1cncn1)N(C)C

InChI Key: InChIKey=PJNAJZSNGGHTRM-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50120455   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cytochrome P450 26A1 (Homo sapiens (Human))	BDBM50120455 (CHEMBL3617993) Show SMILES CC(C(c1ccc(Nc2nc3ccccc3s2)cc1)n1cncn1)N(C)C Show InChI InChI=1S/C20H22N6S/c1-14(25(2)3)19(26-13-21-12-22-26)15-8-10-16(11-9-15)23-20-24-17-6-4-5-7-18(17)27-20/h4-14,19H,1-3H3,(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of CYP26A1 (unknown origin)				Bioorg Med Chem 23: 6763-73 (2015) BindingDB Entry DOI: 10.7270/Q2668G0C
					More data for this Ligand-Target Pair