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BDBM50101691 CHEMBL3394907

SMILES: COc1cc(\C=N\NC(=O)c2ccc(NC(=O)c3ccccc3)c(COCCN(C)C)c2)cc(Br)c1O

InChI Key: InChIKey=FJFJFSODLBAVLR-MUFRIFMGSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50101691   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Histone chaperone ASF1A


(Homo sapiens (Human))		BDBM50101691
PNG
(CHEMBL3394907)
Show SMILES COc1cc(\C=N\NC(=O)c2ccc(NC(=O)c3ccccc3)c(COCCN(C)C)c2)cc(Br)c1O
Show InChI InChI=1S/C27H29BrN4O5/c1-32(2)11-12-37-17-21-15-20(9-10-23(21)30-26(34)19-7-5-4-6-8-19)27(35)31-29-16-18-13-22(28)25(33)24(14-18)36-3/h4-10,13-16,33H,11-12,17H2,1-3H3,(H,30,34)(H,31,35)/b29-16+
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/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