BDBM50313772 (S)-benzyl 5-guanidino-1-oxo-1-(pyridin-2-yl)pentan-2-ylcarbamate::CHEMBL1080400

SMILES: [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-c1ccccn1

InChI Key: InChIKey=OVXXVPKMQFKNHO-INIZCTEOSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50313772   

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
Metacaspase-2 (Trypanosoma brucei)	BDBM50313772 ((S)-benzyl 5-guanidino-1-oxo-1-(pyridin-2-yl)penta...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-c1ccccn1 |r| Show InChI InChI=1S/C19H23N5O3/c20-18(21)23-12-6-10-16(17(25)15-9-4-5-11-22-15)24-19(26)27-13-14-7-2-1-3-8-14/h1-5,7-9,11,16H,6,10,12-13H2,(H,24,26)(H4,20,21,23)/t16-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei MAC2				Bioorg Med Chem Lett 20: 2001-6 (2010) Article DOI: 10.1016/j.bmcl.2010.01.099 BindingDB Entry DOI: 10.7270/Q2BG2P5T
					More data for this Ligand-Target Pair