BDBM50501457 CHEMBL4084437

SMILES: COc1ccc2ccccc2c1Cn1cnc2sc3CC(CCc3c2c1=O)NCC1CCCO1

InChI Key: InChIKey=BOVOWGBECDGYQJ-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 = 50501457   

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
NAD-dependent deacetylase sirtuin 2 (Homo sapiens (Human))	BDBM50501457 (CHEMBL4084437) Show SMILES COc1ccc2ccccc2c1Cn1cnc2sc3CC(CCc3c2c1=O)NCC1CCCO1 Show InChI InChI=1S/C27H29N3O3S/c1-32-23-11-8-17-5-2-3-7-20(17)22(23)15-30-16-29-26-25(27(30)31)21-10-9-18(13-24(21)34-26)28-14-19-6-4-12-33-19/h2-3,5,7-8,11,16,18-19,28H,4,6,9-10,12-15H2,1H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College Curated by ChEMBL					Assay Description Inhibition of recombinant human C-terminal His-tagged SIRT2 (50 to 389 end residues) expressed in Escherichia coli using p53 derived (379 to 382 resi...				J Med Chem 60: 1928-1945 (2017) Article DOI: 10.1021/acs.jmedchem.6b01690 BindingDB Entry DOI: 10.7270/Q23F4SP1
					More data for this Ligand-Target Pair