BDBM50084623 4-Azido-1-(toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid (1-formyl-2-phenyl-ethyl)-amide::CHEMBL115073

SMILES: Cc1ccc(cc1)S(=O)(=O)N1CC(CC1C(=O)N[C@@H](Cc1ccccc1)C=O)N=[N+]=[N-]

InChI Key: InChIKey=MJCWWRJKJMHIET-FDYSRKEFSA-N

Data: 2 IC50

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 = 50084623   

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
Cathepsin B (Homo sapiens (Human))	BDBM50084623 (4-Azido-1-(toluene-4-sulfonyl)-pyrrolidine-2-carbo...) Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CC(CC1C(=O)N[C@@H](Cc1ccccc1)C=O)N=[N+]=[N-] Show InChI InChI=1S/C21H23N5O4S/c1-15-7-9-19(10-8-15)31(29,30)26-13-17(24-25-22)12-20(26)21(28)23-18(14-27)11-16-5-3-2-4-6-16/h2-10,14,17-18,20H,11-13H2,1H3,(H,23,28)/t17?,18-,20?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Queensland Curated by ChEMBL					Assay Description Inhibitory activity against cathepsin B.				J Med Chem 43: 305-41 (2000) Checked by Author BindingDB Entry DOI: 10.7270/Q2JD4XH4
					More data for this Ligand-Target Pair
Calpain1 (Homo sapiens (Human))	BDBM50084623 (4-Azido-1-(toluene-4-sulfonyl)-pyrrolidine-2-carbo...) Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CC(CC1C(=O)N[C@@H](Cc1ccccc1)C=O)N=[N+]=[N-] Show InChI InChI=1S/C21H23N5O4S/c1-15-7-9-19(10-8-15)31(29,30)26-13-17(24-25-22)12-20(26)21(28)23-18(14-27)11-16-5-3-2-4-6-16/h2-10,14,17-18,20H,11-13H2,1H3,(H,23,28)/t17?,18-,20?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
University of Queensland Curated by ChEMBL					Assay Description Inhibitory activity against calpain.				J Med Chem 43: 305-41 (2000) Checked by Author BindingDB Entry DOI: 10.7270/Q2JD4XH4
					More data for this Ligand-Target Pair