BDBM50065878 2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid ((R)-1-phenyl-ethyl)-amide::CHEMBL32486

SMILES: C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1

InChI Key: InChIKey=JKAFBTSIQWNSFP-FWJOYPJLSA-N

Data: 6 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 6 hits for monomerid = 50065878   

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
Human rhinovirus A protease (Human rhinovirus B)	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against human cytomegalovirus (HCMV) protease				J Med Chem 41: 2882-91 (1998) Article DOI: 10.1021/jm980131z BindingDB Entry DOI: 10.7270/Q2X63M2J
					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against human leukocyte elastase protease(HLE)				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Human herpes virus 5 capsid protein P40 (Human cytomegalovirus (strain AD169) (HHV-5) (Huma...)	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against human cytomegalovirus(HCMV) protease				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Pancreatic elastase (Sus scrofa)	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against porcine pancreatic elastase(PPE)				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against Cathepsin B				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair