BDBM50051129 CHEMBL3318297

SMILES: COc1cc2nc(nc(NCCCCC(=O)N3CCCC3)c2cc1OC)N1CCCC1

InChI Key: InChIKey=GOENZIGNECHYKD-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50051129   

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
N-lysine methyltransferase KMT5A (Homo sapiens (Human))	BDBM50051129 (CHEMBL3318297) Show SMILES COc1cc2nc(nc(NCCCCC(=O)N3CCCC3)c2cc1OC)N1CCCC1 Show InChI InChI=1S/C23H33N5O3/c1-30-19-15-17-18(16-20(19)31-2)25-23(28-13-7-8-14-28)26-22(17)24-10-4-3-9-21(29)27-11-5-6-12-27/h15-16H,3-14H2,1-2H3,(H,24,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Inhibition of SETD8 (unknown origin) catalytic domain expressed in Escherichia coli using biotinylated H4 (1-24) peptide substrate after 1 hr by scin...				J Med Chem 57: 6822-33 (2014) Article DOI: 10.1021/jm500871s BindingDB Entry DOI: 10.7270/Q2J9681Q
					More data for this Ligand-Target Pair