BDBM50101707 CHEMBL3394904

SMILES: COc1cc(\C=N\NC(=O)c2ccc(NC(=O)c3ccccn3)cc2)cc(Br)c1O

InChI Key: InChIKey=XXUXBLAPIWSZSO-WYMPLXKRSA-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 = 50101707   

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))	BDBM50101707 (CHEMBL3394904) Show SMILES COc1cc(\C=N\NC(=O)c2ccc(NC(=O)c3ccccn3)cc2)cc(Br)c1O Show InChI InChI=1S/C21H17BrN4O4/c1-30-18-11-13(10-16(22)19(18)27)12-24-26-20(28)14-5-7-15(8-6-14)25-21(29)17-4-2-3-9-23-17/h2-12,27H,1H3,(H,25,29)(H,26,28)/b24-12+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.50E+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