BDBM50292184 2-[3-Cyano-6-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-1-oxy-pyridin-2-yl]-N-(3-fluoro-pyridin-2-ylmethyl)-acetamide::CHEMBL371309

SMILES: [O-][n+]1c(NCC(F)(F)c2ccccn2)ccc(C#N)c1CC(=O)NCc1ncccc1F

InChI Key: InChIKey=ZWVYGCIFBNEGDO-UHFFFAOYSA-N

Data: 1 KI

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 = 50292184   

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
Prothrombin (Homo sapiens (Human))	BDBM50292184 (2-[3-Cyano-6-(2,2-difluoro-2-pyridin-2-yl-ethylami...) Show SMILES [O-][n+]1c(NCC(F)(F)c2ccccn2)ccc(C#N)c1CC(=O)NCc1ncccc1F Show InChI InChI=1S/C21H17F3N6O2/c22-15-4-3-9-26-16(15)12-28-20(31)10-17-14(11-25)6-7-19(30(17)32)29-13-21(23,24)18-5-1-2-8-27-18/h1-9,29H,10,12-13H2,(H,28,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity against thrombin in human plasma				Bioorg Med Chem Lett 15: 2771-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.110 BindingDB Entry DOI: 10.7270/Q2PN96C6
					More data for this Ligand-Target Pair