BDBM50290966 (R)-4-Methyl-2-[2-(naphthalene-2-sulfonyl)-ethyl]-pentanoic acid ((S)-1-formyl-3-methyl-butyl)-amide::CHEMBL100316

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CCS(=O)(=O)c1ccc2ccccc2c1)CC(C)C)C=O

InChI Key: InChIKey=ZIHDCWGBLPZTRG-VXKWHMMOSA-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 = 50290966   

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))	BDBM50290966 ((R)-4-Methyl-2-[2-(naphthalene-2-sulfonyl)-ethyl]-...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](CCS(=O)(=O)c1ccc2ccccc2c1)CC(C)C)C=O Show InChI InChI=1S/C24H33NO4S/c1-17(2)13-21(24(27)25-22(16-26)14-18(3)4)11-12-30(28,29)23-10-9-19-7-5-6-8-20(19)15-23/h5-10,15-18,21-22H,11-14H2,1-4H3,(H,25,27)/t21-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity of the compound was determined using cysteine protease, Cathepsin B with Cbz-Phe-Arg-AMC as substrate.				Bioorg Med Chem Lett 7: 287-290 (1997) Article DOI: 10.1016/S0960-894X(97)00003-6 BindingDB Entry DOI: 10.7270/Q2KS6RJC
					More data for this Ligand-Target Pair
Calpain1 (Homo sapiens (Human))	BDBM50290966 ((R)-4-Methyl-2-[2-(naphthalene-2-sulfonyl)-ethyl]-...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](CCS(=O)(=O)c1ccc2ccccc2c1)CC(C)C)C=O Show InChI InChI=1S/C24H33NO4S/c1-17(2)13-21(24(27)25-22(16-26)14-18(3)4)11-12-30(28,29)23-10-9-19-7-5-6-8-20(19)15-23/h5-10,15-18,21-22H,11-14H2,1-4H3,(H,25,27)/t21-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity of the compound was determined using recombinant human Calpain 1 with Suc-Leu-Tyr-MNA as substrate.				Bioorg Med Chem Lett 7: 287-290 (1997) Article DOI: 10.1016/S0960-894X(97)00003-6 BindingDB Entry DOI: 10.7270/Q2KS6RJC
					More data for this Ligand-Target Pair