BDBM50138761 5-Methylsulfanyl-3-p-tolyl-[1,2,4]triazole-1-carboxylic acid methyl-phenyl-amide::CHEMBL130112::N-methyl-5-(methylthio)-N-phenyl-3-p-tolyl-1H-1,2,4-triazole-1-carboxamide

SMILES: CSc1nc(nn1C(=O)N(C)c1ccccc1)-c1ccc(C)cc1

InChI Key: InChIKey=AAXQEELWFXEVAH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50138761   

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
Acetylcholinesterase (Homo sapiens (Human))	BDBM50138761 (5-Methylsulfanyl-3-p-tolyl-[1,2,4]triazole-1-carbo...) Show SMILES CSc1nc(nn1C(=O)N(C)c1ccccc1)-c1ccc(C)cc1 Show InChI InChI=1S/C18H18N4OS/c1-13-9-11-14(12-10-13)16-19-17(24-3)22(20-16)18(23)21(2)15-7-5-4-6-8-15/h4-12H,1-3H3	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	2.40E+3	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
Hormone-sensitive lipase (HSL) (Rattus norvegicus (Rat))	BDBM50138761 (5-Methylsulfanyl-3-p-tolyl-[1,2,4]triazole-1-carbo...) Show SMILES CSc1nc(nn1C(=O)N(C)c1ccccc1)-c1ccc(C)cc1 Show InChI InChI=1S/C18H18N4OS/c1-13-9-11-14(12-10-13)16-19-17(24-3)22(20-16)18(23)21(2)15-7-5-4-6-8-15/h4-12H,1-3H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76	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
Hormone-sensitive lipase (HSL) (Homo sapiens (Human))	BDBM50138761 (5-Methylsulfanyl-3-p-tolyl-[1,2,4]triazole-1-carbo...) Show SMILES CSc1nc(nn1C(=O)N(C)c1ccccc1)-c1ccc(C)cc1 Show InChI InChI=1S/C18H18N4OS/c1-13-9-11-14(12-10-13)16-19-17(24-3)22(20-16)18(23)21(2)15-7-5-4-6-8-15/h4-12H,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt 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 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