BDBM50401158 CHEMBL2205780

SMILES: CCNC(=O)C(C)(C)C(c1ccc(Nc2ccccc2)cc1)n1ccnc1

InChI Key: InChIKey=YQROPEFKPYTAAN-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 = 50401158   

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 CYP26A1 (Homo sapiens (Human))	BDBM50401158 (CHEMBL2205780) Show SMILES CCNC(=O)C(C)(C)C(c1ccc(Nc2ccccc2)cc1)n1ccnc1 Show InChI InChI=1S/C22H26N4O/c1-4-24-21(27)22(2,3)20(26-15-14-23-16-26)17-10-12-19(13-11-17)25-18-8-6-5-7-9-18/h5-16,20,25H,4H2,1-3H3,(H,24,27)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Cardiff University Curated by ChEMBL					Assay Description Inhibition of CYP26A1 in human MCF7 cell microsomes using [3H]ATRA as substrate after 1 hr by scintillation counter analysis				Bioorg Med Chem 20: 4201-7 (2012) Article DOI: 10.1016/j.bmc.2012.05.076 BindingDB Entry DOI: 10.7270/Q2CZ3895
					More data for this Ligand-Target Pair