BDBM50364915 CHEMBL1950179

SMILES: CCOC(=O)C(CCCC(O)=O)=NNc1ccc(I)cc1

InChI Key: InChIKey=QSWXGJDRYMYJSD-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 = 50364915   

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
Kynurenine--oxoglutarate transaminase 1 (Homo sapiens (Human))	BDBM50364915 (CHEMBL1950179) Show SMILES CCOC(=O)C(CCCC(O)=O)=NNc1ccc(I)cc1 |w:12.12| Show InChI InChI=1S/C14H17IN2O4/c1-2-21-14(20)12(4-3-5-13(18)19)17-16-11-8-6-10(15)7-9-11/h6-9,16H,2-5H2,1H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of human recombinant KAT1 after 20 mins by RP-HPLC analysis				Bioorg Med Chem Lett 22: 1579-81 (2012) Article DOI: 10.1016/j.bmcl.2011.12.138 BindingDB Entry DOI: 10.7270/Q2891693
					More data for this Ligand-Target Pair