BDBM50101746 CHEMBL3394891

SMILES: COc1cc(\C=N\NC(=O)c2ccc(NC(=O)CCl)cc2)cc(Br)c1O

InChI Key: InChIKey=PVPGIWTVFMFAFF-AWQFTUOYSA-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 = 50101746   

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 chaperone ASF1A (Homo sapiens (Human))	BDBM50101746 (CHEMBL3394891) Show SMILES COc1cc(\C=N\NC(=O)c2ccc(NC(=O)CCl)cc2)cc(Br)c1O Show InChI InChI=1S/C17H15BrClN3O4/c1-26-14-7-10(6-13(18)16(14)24)9-20-22-17(25)11-2-4-12(5-3-11)21-15(23)8-19/h2-7,9,24H,8H2,1H3,(H,21,23)(H,22,25)/b20-9+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Colorado State University Curated by ChEMBL					Assay Description Inhibition of His-tagged human Asf1a binding with H3/H4 assessed as fluorescence intensity after 30 mins by ALPHA assay				Bioorg Med Chem Lett 25: 963-8 (2015) Article DOI: 10.1016/j.bmcl.2014.11.067 BindingDB Entry DOI: 10.7270/Q2VM4F0G
					More data for this Ligand-Target Pair