Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptophan 2,3-dioxygenase' and Ligand = 'BDBM339957'   

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
Tryptophan 2,3-dioxygenase (Homo sapiens (Human))	BDBM339957 (2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)amino)...) Show SMILES OCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12 Show InChI InChI=1S/C15H14FN3O/c16-11-2-3-12-13(9-18-14(12)7-11)10-1-4-15(19-8-10)17-5-6-20/h1-4,7-9,18,20H,5-6H2,(H,17,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	490	n/a	n/a	n/a	n/a	n/a	n/a
iTeos Therapeutics US Patent					Assay Description The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...				US Patent US9758505 (2017) BindingDB Entry DOI: 10.7270/Q20V8FW9
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