BDBM494785 2-[(4-{N-[(1S)-6-fluoro-2,3- dihydro-1H-inden-1-yl]-N'- hydroxycarbamimidoyl}-1,2,5- oxadiazol-3-yl)sulfanyl]-N-(1- yl)acetamide::US10988487, Example 181

SMILES: CC(C)(CO)NC(=O)CSc1nonc1\C(N[C@H]1CCc2ccc(F)cc12)=N\O

InChI Key: InChIKey=ZQYHEJDCBPSQMV-ZDUSSCGKSA-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 = 494785   

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))	BDBM494785 (2-[(4-{N-[(1S)-6-fluoro-2,3- dihydro-1H-inden-1-yl...) Show SMILES CC(C)(CO)NC(=O)CSc1nonc1\C(N[C@H]1CCc2ccc(F)cc12)=N\O |r| Show InChI InChI=1S/C18H22FN5O4S/c1-18(2,9-25)21-14(26)8-29-17-15(23-28-24-17)16(22-27)20-13-6-4-10-3-5-11(19)7-12(10)13/h3,5,7,13,25,27H,4,6,8-9H2,1-2H3,(H,20,22)(H,21,26)/t13-/m0/s1	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	59.2	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)
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