Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50045289   

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 E (Homo sapiens (Human))	BDBM50045289 (6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfony...) Show SMILES CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCCNC(=S)NC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H58N6O7S2/c1-3-27(41)24-31(42)29(22-25-12-6-4-7-13-25)38-32(43)28(16-10-11-17-36-34(48)35-2)37-33(44)30(23-26-14-8-5-9-15-26)39-49(45,46)40-18-20-47-21-19-40/h5,8-9,14-15,25,27-31,39,41-42H,3-4,6-7,10-13,16-24H2,1-2H3,(H,37,44)(H,38,43)(H2,35,36,48)/t27-,28-,29-,30-,31-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Binding affinity against human cathepsin E				J Med Chem 36: 2614-20 (1993) BindingDB Entry DOI: 10.7270/Q2X0664J
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50045289 (6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfony...) Show SMILES CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCCNC(=S)NC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H58N6O7S2/c1-3-27(41)24-31(42)29(22-25-12-6-4-7-13-25)38-32(43)28(16-10-11-17-36-34(48)35-2)37-33(44)30(23-26-14-8-5-9-15-26)39-49(45,46)40-18-20-47-21-19-40/h5,8-9,14-15,25,27-31,39,41-42H,3-4,6-7,10-13,16-24H2,1-2H3,(H,37,44)(H,38,43)(H2,35,36,48)/t27-,28-,29-,30-,31-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Binding affinity against human cathepsin D				J Med Chem 36: 2614-20 (1993) BindingDB Entry DOI: 10.7270/Q2X0664J
					More data for this Ligand-Target Pair
Gastricsin (Homo sapiens (Human))	BDBM50045289 (6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfony...) Show SMILES CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCCNC(=S)NC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H58N6O7S2/c1-3-27(41)24-31(42)29(22-25-12-6-4-7-13-25)38-32(43)28(16-10-11-17-36-34(48)35-2)37-33(44)30(23-26-14-8-5-9-15-26)39-49(45,46)40-18-20-47-21-19-40/h5,8-9,14-15,25,27-31,39,41-42H,3-4,6-7,10-13,16-24H2,1-2H3,(H,37,44)(H,38,43)(H2,35,36,48)/t27-,28-,29-,30-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Binding affinity against human gastricsin				J Med Chem 36: 2614-20 (1993) BindingDB Entry DOI: 10.7270/Q2X0664J
					More data for this Ligand-Target Pair
Pepsin A-5 (Homo sapiens (Human))	BDBM50045289 (6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfony...) Show SMILES CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCCNC(=S)NC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H58N6O7S2/c1-3-27(41)24-31(42)29(22-25-12-6-4-7-13-25)38-32(43)28(16-10-11-17-36-34(48)35-2)37-33(44)30(23-26-14-8-5-9-15-26)39-49(45,46)40-18-20-47-21-19-40/h5,8-9,14-15,25,27-31,39,41-42H,3-4,6-7,10-13,16-24H2,1-2H3,(H,37,44)(H,38,43)(H2,35,36,48)/t27-,28-,29-,30-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Binding affinity against human pepsin				J Med Chem 36: 2614-20 (1993) BindingDB Entry DOI: 10.7270/Q2X0664J
					More data for this Ligand-Target Pair