Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50053847   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cathepsin B (Bos taurus (bovine))	BDBM50053847 ((1-{1-[2-(1H-Indol-3-yl)-ethylaminooxalyl]-propylc...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCCc1c[nH]c2ccccc12 Show InChI InChI=1S/C29H36N4O5/c1-4-23(26(34)28(36)30-15-14-21-17-31-24-13-9-8-12-22(21)24)32-27(35)25(16-19(2)3)33-29(37)38-18-20-10-6-5-7-11-20/h5-13,17,19,23,25,31H,4,14-16,18H2,1-3H3,(H,30,36)(H,32,35)(H,33,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	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))	BDBM50053847 ((1-{1-[2-(1H-Indol-3-yl)-ethylaminooxalyl]-propylc...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCCc1c[nH]c2ccccc12 Show InChI InChI=1S/C29H36N4O5/c1-4-23(26(34)28(36)30-15-14-21-17-31-24-13-9-8-12-22(21)24)32-27(35)25(16-19(2)3)33-29(37)38-18-20-10-6-5-7-11-20/h5-13,17,19,23,25,31H,4,14-16,18H2,1-3H3,(H,30,36)(H,32,35)(H,33,37)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	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))	BDBM50053847 ((1-{1-[2-(1H-Indol-3-yl)-ethylaminooxalyl]-propylc...) Show SMILES CCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCCc1c[nH]c2ccccc12 Show InChI InChI=1S/C29H36N4O5/c1-4-23(26(34)28(36)30-15-14-21-17-31-24-13-9-8-12-22(21)24)32-27(35)25(16-19(2)3)33-29(37)38-18-20-10-6-5-7-11-20/h5-13,17,19,23,25,31H,4,14-16,18H2,1-3H3,(H,30,36)(H,32,35)(H,33,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	300	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