BDBM50195114 (S)-N-ethyl-2-(2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamido)-8-oxononanamide::CHEMBL386965

SMILES: CCNC(=O)[C@H](CCCCCC(C)=O)NC(=O)Cc1c(C)[nH]c2ccc(OC)cc12

InChI Key: InChIKey=ZWOVPZQIBOSZRL-NRFANRHFSA-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 = 50195114   

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))	BDBM50195114 ((S)-N-ethyl-2-(2-(5-methoxy-2-methyl-1H-indol-3-yl...) Show SMILES CCNC(=O)[C@H](CCCCCC(C)=O)NC(=O)Cc1c(C)[nH]c2ccc(OC)cc12 Show InChI InChI=1S/C23H33N3O4/c1-5-24-23(29)21(10-8-6-7-9-15(2)27)26-22(28)14-18-16(3)25-20-12-11-17(30-4)13-19(18)20/h11-13,21,25H,5-10,14H2,1-4H3,(H,24,29)(H,26,28)/t21-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
IRBM/Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of HDAC1 (mean IC50)				Bioorg Med Chem Lett 16: 5948-52 (2006) Article DOI: 10.1016/j.bmcl.2006.09.002 BindingDB Entry DOI: 10.7270/Q2RN38PD
					More data for this Ligand-Target Pair