BDBM50138747 (3-(4-chlorophenyl)-5-(cyclopropylmethylthio)-1H-1,2,4-triazol-1-yl)(piperidin-1-yl)methanone::CHEMBL336398::[3-(4-Chloro-phenyl)-5-cyclopropylmethylsulfanyl-[1,2,4]triazol-1-yl]-piperidin-1-yl-methanone

SMILES: Clc1ccc(cc1)-c1nc(SCC2CC2)n(n1)C(=O)N1CCCCC1

InChI Key: InChIKey=XWIIHZHUZCWNLW-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50138747   

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
Hormone-sensitive lipase (Homo sapiens (Human))	BDBM50138747 ((3-(4-chlorophenyl)-5-(cyclopropylmethylthio)-1H-1...) Show SMILES Clc1ccc(cc1)-c1nc(SCC2CC2)n(n1)C(=O)N1CCCCC1 Show InChI InChI=1S/C18H21ClN4OS/c19-15-8-6-14(7-9-15)16-20-17(25-12-13-4-5-13)23(21-16)18(24)22-10-2-1-3-11-22/h6-9,13H,1-5,10-12H2	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Novo Nordisk A/S Curated by ChEMBL					Assay Description Inhibition of hormone sensitive lipase (HSL).				J Med Chem 47: 400-10 (2004) Article DOI: 10.1021/jm031004s BindingDB Entry DOI: 10.7270/Q2ZG6RN1
					More data for this Ligand-Target Pair
Hormone-sensitive lipase (Rattus norvegicus (Rat))	BDBM50138747 ((3-(4-chlorophenyl)-5-(cyclopropylmethylthio)-1H-1...) Show SMILES Clc1ccc(cc1)-c1nc(SCC2CC2)n(n1)C(=O)N1CCCCC1 Show InChI InChI=1S/C18H21ClN4OS/c19-15-8-6-14(7-9-15)16-20-17(25-12-13-4-5-13)23(21-16)18(24)22-10-2-1-3-11-22/h6-9,13H,1-5,10-12H2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.53	n/a	n/a	n/a	n/a	n/a	n/a
University of Jordan Curated by ChEMBL					Assay Description Inhibition of HSL in Wistar rat isolated fat cells by spectrophotometric assay				J Med Chem 51: 6478-94 (2008) Article DOI: 10.1021/jm800718k BindingDB Entry DOI: 10.7270/Q23778KJ
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50138747 ((3-(4-chlorophenyl)-5-(cyclopropylmethylthio)-1H-1...) Show SMILES Clc1ccc(cc1)-c1nc(SCC2CC2)n(n1)C(=O)N1CCCCC1 Show InChI InChI=1S/C18H21ClN4OS/c19-15-8-6-14(7-9-15)16-20-17(25-12-13-4-5-13)23(21-16)18(24)22-10-2-1-3-11-22/h6-9,13H,1-5,10-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Novo Nordisk A/S Curated by ChEMBL					Assay Description Inhibitory concentration against butyrylcholinesterase.				J Med Chem 47: 400-10 (2004) Article DOI: 10.1021/jm031004s BindingDB Entry DOI: 10.7270/Q2ZG6RN1
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50138747 ((3-(4-chlorophenyl)-5-(cyclopropylmethylthio)-1H-1...) Show SMILES Clc1ccc(cc1)-c1nc(SCC2CC2)n(n1)C(=O)N1CCCCC1 Show InChI InChI=1S/C18H21ClN4OS/c19-15-8-6-14(7-9-15)16-20-17(25-12-13-4-5-13)23(21-16)18(24)22-10-2-1-3-11-22/h6-9,13H,1-5,10-12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Novo Nordisk A/S Curated by ChEMBL					Assay Description Inhibitory concentration against acetylcholinesterase				J Med Chem 47: 400-10 (2004) Article DOI: 10.1021/jm031004s BindingDB Entry DOI: 10.7270/Q2ZG6RN1
					More data for this Ligand-Target Pair