BDBM50149199 6-Hydroxy-2,5,7,8-tetramethyl-chroman-2-carboxylic acid [(S)-1-((S)-2-hydroxy-tetrahydro-furan-3-ylcarbamoyl)-3-methyl-butyl]-amide::CHEMBL123621

SMILES: CC(C)C[C@H](NC(=O)C1(C)CCc2c(C)c(O)c(C)c(C)c2O1)C(=O)N[C@H]1CCOC1O

InChI Key: InChIKey=WPHHUDOBVBINRM-LPUUFBPRSA-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 = 50149199   

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))	BDBM50149199 (6-Hydroxy-2,5,7,8-tetramethyl-chroman-2-carboxylic...) Show SMILES CC(C)C[C@H](NC(=O)C1(C)CCc2c(C)c(O)c(C)c(C)c2O1)C(=O)N[C@H]1CCOC1O Show InChI InChI=1S/C24H36N2O6/c1-12(2)11-18(21(28)25-17-8-10-31-22(17)29)26-23(30)24(6)9-7-16-15(5)19(27)13(3)14(4)20(16)32-24/h12,17-18,22,27,29H,7-11H2,1-6H3,(H,25,28)(H,26,30)/t17-,18-,22?,24?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	147	n/a	n/a	n/a	n/a	n/a	n/a
Institut Henri Beaufour Curated by ChEMBL					Assay Description Inhibitory activity against on human calpain 1				Bioorg Med Chem Lett 14: 3825-8 (2004) Article DOI: 10.1016/j.bmcl.2004.04.105 BindingDB Entry DOI: 10.7270/Q2NK3DH6
					More data for this Ligand-Target Pair