BDBM50353246 CHEMBL1830409

SMILES: CC(C)c1nc2cc(\C=C\C(=O)NO)ccc2n1CC(C)(C)CN(C)C

InChI Key: InChIKey=GQVZZIGSSJLRHG-CSKARUKUSA-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 = 50353246   

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))	BDBM50353246 (CHEMBL1830409) Show SMILES CC(C)c1nc2cc(\C=C\C(=O)NO)ccc2n1CC(C)(C)CN(C)C Show InChI InChI=1S/C20H30N4O2/c1-14(2)19-21-16-11-15(8-10-18(25)22-26)7-9-17(16)24(19)13-20(3,4)12-23(5)6/h7-11,14,26H,12-13H2,1-6H3,(H,22,25)/b10-8+	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	308	n/a	n/a	n/a	n/a	n/a	n/a
S*BIO Pte Ltd. Curated by ChEMBL					Assay Description Inhibition of full length recombinant HDAC1 using Fluor de Lys as substrate by fluorescence assay				J Med Chem 54: 4694-720 (2011) Article DOI: 10.1021/jm2003552 BindingDB Entry DOI: 10.7270/Q29S1RD6
					More data for this Ligand-Target Pair