BDBM50391718 CHEMBL2146985

SMILES: COC(=O)C(C)(C)C(c1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1)n1ccnc1

InChI Key: InChIKey=SFBZZBVJJZCPGW-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 = 50391718   

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))	BDBM50391718 (CHEMBL2146985) Show SMILES COC(=O)C(C)(C)C(c1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1)n1ccnc1 Show InChI InChI=1S/C24H29N3O5/c1-24(2,23(28)32-6)22(27-12-11-25-15-27)16-7-9-17(10-8-16)26-18-13-19(29-3)21(31-5)20(14-18)30-4/h7-15,22,26H,1-6H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Cardiff University Curated by ChEMBL					Assay Description Inhibition of CYP26A1-mediated retionic acid metabolism in human MCF7 cell microsomes using [3H]ATRA as substrate after 1 hr by scintillation countin...				Bioorg Med Chem 20: 6080-8 (2012) Article DOI: 10.1016/j.bmc.2012.08.044 BindingDB Entry DOI: 10.7270/Q2D21ZQD
					More data for this Ligand-Target Pair