BDBM50428662 CHEMBL573014

SMILES: COc1ccc(cc1)C(=O)CNc1cc(O)c2n(cc(CCNC(=O)OC(C)(C)C)c2c1O)S(=O)(=O)c1ccc(C)cc1

InChI Key: InChIKey=RCSAAGODMRKZKY-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 = 50428662   

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
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50428662 (CHEMBL573014) Show SMILES COc1ccc(cc1)C(=O)CNc1cc(O)c2n(cc(CCNC(=O)OC(C)(C)C)c2c1O)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C31H35N3O8S/c1-19-6-12-23(13-7-19)43(39,40)34-18-21(14-15-32-30(38)42-31(2,3)4)27-28(34)25(35)16-24(29(27)37)33-17-26(36)20-8-10-22(41-5)11-9-20/h6-13,16,18,33,35,37H,14-15,17H2,1-5H3,(H,32,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human recombinant IDO1 using L-Trp as substrate assessed as kynurenine level after 30 mins				Bioorg Med Chem Lett 23: 47-54 (2012) Article DOI: 10.1016/j.bmcl.2012.11.036 BindingDB Entry DOI: 10.7270/Q2JM2C03
					More data for this Ligand-Target Pair