BDBM50123489 2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-N-pyridin-2-ylmethyl-acetamide::CHEMBL143060

SMILES: Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccccn1

InChI Key: InChIKey=IOTXWKCEEOXTJU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50123489   

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))	BDBM50123489 (2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl...) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccccn1 Show InChI InChI=1S/C21H23N5O2/c1-16-13-25-20(23-12-10-17-7-3-2-4-8-17)21(28)26(16)15-19(27)24-14-18-9-5-6-11-22-18/h2-9,11,13H,10,12,14-15H2,1H3,(H,23,25)(H,24,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory constant against thrombin (IIa)				J Med Chem 46: 461-73 (2003) Article DOI: 10.1021/jm020311f BindingDB Entry DOI: 10.7270/Q2W958J5
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50123489 (2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl...) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccccn1 Show InChI InChI=1S/C21H23N5O2/c1-16-13-25-20(23-12-10-17-7-3-2-4-8-17)21(28)26(16)15-19(27)24-14-18-9-5-6-11-22-18/h2-9,11,13H,10,12,14-15H2,1H3,(H,23,25)(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory constant against human trypsin				J Med Chem 46: 461-73 (2003) Article DOI: 10.1021/jm020311f BindingDB Entry DOI: 10.7270/Q2W958J5
					More data for this Ligand-Target Pair