BDBM50226117 CHEMBL396444::N-(2-aminophenyl)-4-((4-oxochroman-3-yl)methyl)benzamide

SMILES: Nc1ccccc1NC(=O)c1ccc(CC2COc3ccccc3C2=O)cc1

InChI Key: InChIKey=VZSBSGMJXMQMFU-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 = 50226117   

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
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50226117 (CHEMBL396444 | N-(2-aminophenyl)-4-((4-oxochroman-...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CC2COc3ccccc3C2=O)cc1 Show InChI InChI=1S/C23H20N2O3/c24-19-6-2-3-7-20(19)25-23(27)16-11-9-15(10-12-16)13-17-14-28-21-8-4-1-5-18(21)22(17)26/h1-12,17H,13-14,24H2,(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1 expressed in insect Sf9 cells				Bioorg Med Chem Lett 17: 6729-33 (2007) Article DOI: 10.1016/j.bmcl.2007.10.050 BindingDB Entry DOI: 10.7270/Q2V124J9
					More data for this Ligand-Target Pair