Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4' and Ligand = 'BDBM50578804'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50578804 (CHEMBL4846393) Show SMILES COc1cc2c3n(Cc4ccccn4)c(nc3cnc2cc1-c1c(C)noc1C)C(C)C |(3.79,-7.02,;3.79,-8.56,;5.12,-9.33,;6.45,-8.56,;7.79,-9.33,;9.11,-8.55,;9.43,-7.05,;8.39,-5.91,;8.86,-4.45,;10.37,-4.13,;10.84,-2.67,;9.81,-1.52,;8.29,-1.86,;7.83,-3.32,;10.95,-6.89,;11.58,-8.29,;10.44,-9.32,;10.46,-10.86,;9.12,-11.64,;7.79,-10.87,;6.46,-11.65,;5.12,-10.88,;3.79,-11.65,;2.39,-11.03,;2.06,-9.52,;1.35,-12.17,;2.12,-13.5,;3.63,-13.18,;4.78,-14.21,;11.72,-5.55,;13.26,-5.55,;11.5,-4.11,)| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of Alexa Fluor 647 labelled ligand from recombinant human N-terminal 6His-tagged BRD4-BD1 Y390A mutant (1 to 477 residue) expressed in E...				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00855 BindingDB Entry DOI: 10.7270/Q23T9N20
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50578804 (CHEMBL4846393) Show SMILES COc1cc2c3n(Cc4ccccn4)c(nc3cnc2cc1-c1c(C)noc1C)C(C)C |(3.79,-7.02,;3.79,-8.56,;5.12,-9.33,;6.45,-8.56,;7.79,-9.33,;9.11,-8.55,;9.43,-7.05,;8.39,-5.91,;8.86,-4.45,;10.37,-4.13,;10.84,-2.67,;9.81,-1.52,;8.29,-1.86,;7.83,-3.32,;10.95,-6.89,;11.58,-8.29,;10.44,-9.32,;10.46,-10.86,;9.12,-11.64,;7.79,-10.87,;6.46,-11.65,;5.12,-10.88,;3.79,-11.65,;2.39,-11.03,;2.06,-9.52,;1.35,-12.17,;2.12,-13.5,;3.63,-13.18,;4.78,-14.21,;11.72,-5.55,;13.26,-5.55,;11.5,-4.11,)| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of BRD4 in human PBMC assessed as reduction in LPS-induced IL-6 secretion incubated for 18 to 24 hrs by MSD assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00855 BindingDB Entry DOI: 10.7270/Q23T9N20
					More data for this Ligand-Target Pair