BDBM50131811 CHEMBL3634601

SMILES: Cn1ccnc1COc1cc2oc(=O)n(CCC(O)=O)c2cc1Cl

InChI Key: InChIKey=CBHVUTHBEDBHJJ-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 = 50131811   

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 3-monooxygenase (Homo sapiens (Human))	BDBM50131811 (CHEMBL3634601) Show SMILES Cn1ccnc1COc1cc2oc(=O)n(CCC(O)=O)c2cc1Cl Show InChI InChI=1S/C15H14ClN3O5/c1-18-5-3-17-13(18)8-23-11-7-12-10(6-9(11)16)19(15(22)24-12)4-2-14(20)21/h3,5-7H,2,4,8H2,1H3,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>794	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of kynurenine monooxygenase (unknown origin) by MS rapidfire assay				ACS Med Chem Lett 6: 954-5 (2015) BindingDB Entry DOI: 10.7270/Q2P55QBM
					More data for this Ligand-Target Pair