null

SMILES: CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCc1nc2n(C)c(=O)n(C)c(=O)c2n1C

InChI Key: InChIKey=DOSWSCJFUAOMGE-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50053807   

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 (Bos taurus (bovine))	BDBM50053807 (CHEMBL337608 | {3-Methyl-1-[1-(1,3,7-trimethyl-2,6...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCc1nc2n(C)c(=O)n(C)c(=O)c2n1C Show InChI InChI=1S/C28H37N7O7/c1-7-18(30-24(37)19(13-16(2)3)31-27(40)42-15-17-11-9-8-10-12-17)22(36)25(38)29-14-20-32-23-21(33(20)4)26(39)35(6)28(41)34(23)5/h8-12,16,18-19H,7,13-15H2,1-6H3,(H,29,38)(H,30,37)(H,31,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin B				J Med Chem 39: 4089-98 (1996) Article DOI: 10.1021/jm950541c BindingDB Entry DOI: 10.7270/Q2TX3DGR
					More data for this Ligand-Target Pair
Calpain-2 catalytic subunit (Homo sapiens (Human))	BDBM50053807 (CHEMBL337608 | {3-Methyl-1-[1-(1,3,7-trimethyl-2,6...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCc1nc2n(C)c(=O)n(C)c(=O)c2n1C Show InChI InChI=1S/C28H37N7O7/c1-7-18(30-24(37)19(13-16(2)3)31-27(40)42-15-17-11-9-8-10-12-17)22(36)25(38)29-14-20-32-23-21(33(20)4)26(39)35(6)28(41)34(23)5/h8-12,16,18-19H,7,13-15H2,1-6H3,(H,29,38)(H,30,37)(H,31,40)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	4.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of Cysteine protease Calpain 2				J Med Chem 39: 4089-98 (1996) Article DOI: 10.1021/jm950541c BindingDB Entry DOI: 10.7270/Q2TX3DGR
					More data for this Ligand-Target Pair
Calpain-1 catalytic subunit (Homo sapiens (Human))	BDBM50053807 (CHEMBL337608 | {3-Methyl-1-[1-(1,3,7-trimethyl-2,6...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCc1nc2n(C)c(=O)n(C)c(=O)c2n1C Show InChI InChI=1S/C28H37N7O7/c1-7-18(30-24(37)19(13-16(2)3)31-27(40)42-15-17-11-9-8-10-12-17)22(36)25(38)29-14-20-32-23-21(33(20)4)26(39)35(6)28(41)34(23)5/h8-12,16,18-19H,7,13-15H2,1-6H3,(H,29,38)(H,30,37)(H,31,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry Curated by ChEMBL					Assay Description Inhibition of the cysteine protease human Calpain 1				J Med Chem 39: 4089-98 (1996) Article DOI: 10.1021/jm950541c BindingDB Entry DOI: 10.7270/Q2TX3DGR
					More data for this Ligand-Target Pair