BDBM50291181 CHEMBL150976::{(S)-2-tert-Butoxy-1-[(R)-1-((R)-1-formyl-3-methyl-butylcarbamoyl)-3-methyl-butylcarbamoyl]-ethyl}-carbamic acid benzyl ester

SMILES: CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](COC(C)(C)C)NC(=O)OCc1ccccc1)C=O

InChI Key: InChIKey=IDXZDBCBHDIQIY-ZLNRFVROSA-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 = 50291181   

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))	BDBM50291181 (CHEMBL150976 | {(S)-2-tert-Butoxy-1-[(R)-1-((R)-1-...) Show SMILES CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](COC(C)(C)C)NC(=O)OCc1ccccc1)C=O Show InChI InChI=1S/C27H43N3O6/c1-18(2)13-21(15-31)28-24(32)22(14-19(3)4)29-25(33)23(17-36-27(5,6)7)30-26(34)35-16-20-11-9-8-10-12-20/h8-12,15,18-19,21-23H,13-14,16-17H2,1-7H3,(H,28,32)(H,29,33)(H,30,34)/t21-,22-,23+/m1/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	12	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