null

SMILES: NC(=O)CNc1nonc1\C(NC1CCc2ccc(F)cc12)=N\O

InChI Key: InChIKey=MYELJHWHIZSWOZ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 494742   

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))	BDBM494742 (2-((4-(N-(6-fluoro-2,3-dihydro-1H- inden-1-yl)-N''...) Show SMILES NC(=O)CNc1nonc1\C(NC1CCc2ccc(F)cc12)=N\O Show InChI InChI=1S/C14H15FN6O3/c15-8-3-1-7-2-4-10(9(7)5-8)18-14(19-23)12-13(21-24-20-12)17-6-11(16)22/h1,3,5,10,23H,2,4,6H2,(H2,16,22)(H,17,21)(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description HIS-tagged IDO1 protein was recombinantly expressed in Escherichia coli using ZYP5052 autoinduction media supplemented with 500 μM delta aminole...				US Patent US10988487 (2021)
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM494742 (2-((4-(N-(6-fluoro-2,3-dihydro-1H- inden-1-yl)-N''...) Show SMILES NC(=O)CNc1nonc1\C(NC1CCc2ccc(F)cc12)=N\O Show InChI InChI=1S/C14H15FN6O3/c15-8-3-1-7-2-4-10(9(7)5-8)18-14(19-23)12-13(21-24-20-12)17-6-11(16)22/h1,3,5,10,23H,2,4,6H2,(H2,16,22)(H,17,21)(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	52.4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description HIS-tagged IDO1 protein was recombinantly expressed in Escherichia coli using ZYP5052 autoinduction media supplemented with 500 μM delta aminole...				US Patent US10988487 (2021)
					More data for this Ligand-Target Pair