Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Indoleamine 2,3-dioxygenase 1' and Ligand = 'BDBM50247142'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50247142 (CHEMBL470329 | TX-2228 | [4-(1-Oxido-1,2,4-benzotr...) Show SMILES Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCNc2n[n+]([O-])c3ccccc3n2)c2ccccc12 |r| Show InChI InChI=1S/C28H35N7O4/c1-28(2,3)39-27(37)32-22(17-19-18-34(4)23-13-7-5-11-20(19)23)25(36)29-15-9-10-16-30-26-31-21-12-6-8-14-24(21)35(38)33-26/h5-8,11-14,18,22H,9-10,15-17H2,1-4H3,(H,29,36)(H,32,37)(H,30,31,33)/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.71E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokushima Curated by ChEMBL					Assay Description Inhibition of indoleamine 2,3-dioxygenase (unknown origin) in aerobic condition				Bioorg Med Chem 16: 8661-9 (2008) Article DOI: 10.1016/j.bmc.2008.07.087 BindingDB Entry DOI: 10.7270/Q2W66KKP
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