BDBM50376750 CHEMBL541141

SMILES: NCc1cccc(c1)C(O)=O

InChI Key: InChIKey=GSWYUZQBLVUEPH-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 4 PDB IDs match this monomer.

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 = 50376750   

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
Gamma-amino-N-butyrate transaminase (Homo sapiens (Human))	BDBM50376750 (CHEMBL541141) Show SMILES NCc1cccc(c1)C(O)=O Show InChI InChI=1S/C8H9NO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5,9H2,(H,10,11)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibition of GABA-AT				Bioorg Med Chem Lett 18: 3122-5 (2008) Article DOI: 10.1016/j.bmcl.2007.10.060 BindingDB Entry DOI: 10.7270/Q22J6CRF
					More data for this Ligand-Target Pair