BDBM50462477 CHEMBL4248098

SMILES: Clc1cc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c2c1

InChI Key: InChIKey=AOQXXTWKWNQUCU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50462477   

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
Aspartate aminotransferase, cytoplasmic (Homo sapiens)	BDBM50462477 (CHEMBL4248098) Show SMILES Clc1cc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c2c1 Show InChI InChI=1S/C19H19ClN4O/c20-14-12-17-16(6-7-21-17)18(13-14)23-8-10-24(11-9-23)19(25)22-15-4-2-1-3-5-15/h1-7,12-13,21H,8-11H2,(H,22,25)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
California Institute for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of GOT1 (unknown origin) using aspartate and alpha-ketoglutarate as substrate after 20 mins by MDH1 enzyme-coupled fluorescence assay				Bioorg Med Chem Lett 28: 2675-2678 (2018) Article DOI: 10.1016/j.bmcl.2018.04.061 BindingDB Entry DOI: 10.7270/Q2MC92P6
					More data for this Ligand-Target Pair