BDBM50291209 CHEMBL151679::[(S)-1-{(R)-1-[(S)-1-((S)-1-Formyl-3-methyl-butylcarbamoyl)-3-methyl-butylcarbamoyl]-3-methyl-butylcarbamoyl}-2-(3H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

SMILES: CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C=O

InChI Key: InChIKey=KXLSGKXEVCCJPU-BPXGVECKSA-N

Data: 1 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 1 hit for monomerid = 50291209   

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
Calpain1 (Homo sapiens (Human))	BDBM50291209 (CHEMBL151679 | [(S)-1-{(R)-1-[(S)-1-((S)-1-Formyl-...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C=O Show InChI InChI=1S/C32H48N6O6/c1-20(2)12-25(17-39)35-29(40)26(13-21(3)4)36-30(41)27(14-22(5)6)37-31(42)28(15-24-16-33-19-34-24)38-32(43)44-18-23-10-8-7-9-11-23/h7-11,16-17,19-22,25-28H,12-15,18H2,1-6H3,(H,33,34)(H,35,40)(H,36,41)(H,37,42)(H,38,43)/t25-,26-,27+,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity evaluated against recombinant human calpain 1				Bioorg Med Chem Lett 7: 539-544 (1997) Article DOI: 10.1016/S0960-894X(97)00063-2 BindingDB Entry DOI: 10.7270/Q2W37WBM
					More data for this Ligand-Target Pair