BDBM50292188 2-[3-Chloro-6-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-1-oxy-pyridin-2-yl]-N-(3-[1,2,4]triazol-1-yl-pyridin-2-ylmethyl)-acetamide::CHEMBL370050

SMILES: ON1C(CCC(Cl)=C1CC(=O)NCc1ncccc1-n1cncn1)=NCC(F)(F)c1ccccn1

InChI Key: InChIKey=GWEVGZPJOVXFME-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 = 50292188   

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))	BDBM50292188 (2-[3-Chloro-6-(2,2-difluoro-2-pyridin-2-yl-ethylam...) Show SMILES ON1C(CCC(Cl)=C1CC(=O)NCc1ncccc1-n1cncn1)=NCC(F)(F)c1ccccn1 |w:24.27,c:6| Show InChI InChI=1S/C22H21ClF2N8O2/c23-15-6-7-20(30-12-22(24,25)19-5-1-2-8-28-19)33(35)18(15)10-21(34)29-11-16-17(4-3-9-27-16)32-14-26-13-31-32/h1-5,8-9,13-14,35H,6-7,10-12H2,(H,29,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	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