BDBM25888 (2S)-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]-2-(1H-pyrrol-2-ylformamido)butanamide::N-heterocyclic dipeptide aldehyde, 6

SMILES: CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1ccc[nH]1)C(C)C)C=O

InChI Key: InChIKey=QQXHCWVASSFMJS-JSGCOSHPSA-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 = 25888   

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
Calpain-2 (Ovis aries (sheep))	BDBM25888 ((2S)-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]-2...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1ccc[nH]1)C(C)C)C=O |r| Show InChI InChI=1S/C16H25N3O3/c1-10(2)8-12(9-20)18-16(22)14(11(3)4)19-15(21)13-6-5-7-17-13/h5-7,9-12,14,17H,8H2,1-4H3,(H,18,22)(H,19,21)/t12-,14-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	315	n/a	n/a	n/a	n/a	7.5	25
University of Canterbury					Assay Description Calpain inhibition assays were performed in 96-well black plates. The reaction was initiated by the addition of substrate solution. The progress of t...				Bioorg Med Chem 16: 6911-23 (2008) Article DOI: 10.1016/j.bmc.2008.05.048 BindingDB Entry DOI: 10.7270/Q2C53J5R
					More data for this Ligand-Target Pair
Calpain-1 (Ovis aries (sheep))	BDBM25888 ((2S)-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]-2...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1ccc[nH]1)C(C)C)C=O |r| Show InChI InChI=1S/C16H25N3O3/c1-10(2)8-12(9-20)18-16(22)14(11(3)4)19-15(21)13-6-5-7-17-13/h5-7,9-12,14,17H,8H2,1-4H3,(H,18,22)(H,19,21)/t12-,14-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	7.5	25
University of Canterbury					Assay Description Calpain inhibition assays were performed in 96-well black plates. The reaction was initiated by the addition of substrate solution. The progress of t...				Bioorg Med Chem 16: 6911-23 (2008) Article DOI: 10.1016/j.bmc.2008.05.048 BindingDB Entry DOI: 10.7270/Q2C53J5R
					More data for this Ligand-Target Pair