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SMILES: CC(=NNC(N)=S)c1cccc(c1)-c1ccccc1

InChI Key: InChIKey=OEMPMQMUBMCYOI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50148053   

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
Cruzipain (Trypanosoma cruzi)	BDBM50148053 ((1E)-1-(1,1'-biphenyl-3-yl)ethan-1-one thiosemicar...) Show SMILES CC(=NNC(N)=S)c1cccc(c1)-c1ccccc1 |w:2.2| Show InChI InChI=1S/C15H15N3S/c1-11(17-18-15(16)19)13-8-5-9-14(10-13)12-6-3-2-4-7-12/h2-10H,1H3,(H3,16,18,19)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California-San Francisco Curated by ChEMBL					Assay Description Inhibition of cruzain from Trypanosoma cruzi				J Med Chem 47: 3212-9 (2004) Article DOI: 10.1021/jm030549j BindingDB Entry DOI: 10.7270/Q2Z60NHZ
					More data for this Ligand-Target Pair
Cysteine protease (Trypanosoma brucei rhodesiense)	BDBM50148053 ((1E)-1-(1,1'-biphenyl-3-yl)ethan-1-one thiosemicar...) Show SMILES CC(=NNC(N)=S)c1cccc(c1)-c1ccccc1 |w:2.2| Show InChI InChI=1S/C15H15N3S/c1-11(17-18-15(16)19)13-8-5-9-14(10-13)12-6-3-2-4-7-12/h2-10H,1H3,(H3,16,18,19)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California-San Francisco Curated by ChEMBL					Assay Description Inhibition of rhodesain from Trypanosoma brucei rhodesiense				J Med Chem 47: 3212-9 (2004) Article DOI: 10.1021/jm030549j BindingDB Entry DOI: 10.7270/Q2Z60NHZ
					More data for this Ligand-Target Pair