BDBM494643 US10988487, Example 39

SMILES: CCNC(=O)CSc1nonc1\C(NC1CCc2ccc(F)cc12)=N\O

InChI Key: InChIKey=OPBBUBAGJNYEDT-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 = 494643   

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))	BDBM494643 (US10988487, Example 39) Show SMILES CCNC(=O)CSc1nonc1\C(NC1CCc2ccc(F)cc12)=N\O Show InChI InChI=1S/C16H18FN5O3S/c1-2-18-13(23)8-26-16-14(21-25-22-16)15(20-24)19-12-6-4-9-3-5-10(17)7-11(9)12/h3,5,7,12,24H,2,4,6,8H2,1H3,(H,18,23)(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	54.1	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