Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 170.5 BDBM50277367Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

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 adjacent to zinc finger domain protein 2B (Homo sapiens (Human))	BDBM50277367 (CHEMBL4163507) Show SMILES CNC(=O)c1cc(Cl)ccn1 Show InChI InChI=1S/C7H7ClN2O/c1-9-7(11)6-4-5(8)2-3-10-6/h2-4H,1H3,(H,9,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a
University of Z£rich Curated by ChEMBL					Assay Description Binding affinity to human BAZ2B (S2054 to S2168 residues) expressed in bacterial expression system by BROMOscan assay				Eur J Med Chem 139: 564-572 (2017) Article DOI: 10.1016/j.ejmech.2017.08.028 BindingDB Entry DOI: 10.7270/Q2833VJS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2A (Homo sapiens (Human))	BDBM50277367 (CHEMBL4163507) Show SMILES CNC(=O)c1cc(Cl)ccn1 Show InChI InChI=1S/C7H7ClN2O/c1-9-7(11)6-4-5(8)2-3-10-6/h2-4H,1H3,(H,9,11)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a
University of Z£rich Curated by ChEMBL					Assay Description Binding affinity to human BAZ2A (M1792 to L1905 residues) expressed in bacterial expression system by BROMOscan assay				Eur J Med Chem 139: 564-572 (2017) Article DOI: 10.1016/j.ejmech.2017.08.028 BindingDB Entry DOI: 10.7270/Q2833VJS
					More data for this Ligand-Target Pair				3D Structure (crystal)