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SMILES: Cn1ccc(NC(=O)c2nnc(o2)-c2ccccc2N)n1

InChI Key: InChIKey=WMPGIQDGHIZCND-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50295114   

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)	BDBM50295114 (5-(2-Amino-phenyl)-[1,3,4]oxadiazole-2-carboxylic ...) Show SMILES Cn1ccc(NC(=O)c2nnc(o2)-c2ccccc2N)n1 Show InChI InChI=1S/C13H12N6O2/c1-19-7-6-10(18-19)15-11(20)13-17-16-12(21-13)8-4-2-3-5-9(8)14/h2-7H,14H2,1H3,(H,15,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain preincubated for 5 mins before substrate addition				J Med Chem 52: 5005-8 (2010) Article DOI: 10.1021/jm9009229 BindingDB Entry DOI: 10.7270/Q24J0F50
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM50295114 (5-(2-Amino-phenyl)-[1,3,4]oxadiazole-2-carboxylic ...) Show SMILES Cn1ccc(NC(=O)c2nnc(o2)-c2ccccc2N)n1 Show InChI InChI=1S/C13H12N6O2/c1-19-7-6-10(18-19)15-11(20)13-17-16-12(21-13)8-4-2-3-5-9(8)14/h2-7H,14H2,1H3,(H,15,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain preincubated for 5 mins before substrate addition in presence of 0.01% Triton X-100				J Med Chem 52: 5005-8 (2010) Article DOI: 10.1021/jm9009229 BindingDB Entry DOI: 10.7270/Q24J0F50
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM50295114 (5-(2-Amino-phenyl)-[1,3,4]oxadiazole-2-carboxylic ...) Show SMILES Cn1ccc(NC(=O)c2nnc(o2)-c2ccccc2N)n1 Show InChI InChI=1S/C13H12N6O2/c1-19-7-6-10(18-19)15-11(20)13-17-16-12(21-13)8-4-2-3-5-9(8)14/h2-7H,14H2,1H3,(H,15,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain preincubated for 5 mins before substrate addition in presence of 0.001% Triton X-100				J Med Chem 52: 5005-8 (2010) Article DOI: 10.1021/jm9009229 BindingDB Entry DOI: 10.7270/Q24J0F50
					More data for this Ligand-Target Pair