BDBM50339576 4-(5-Benzyl-3-phenylsulfanylmethyl-3H-[1,2,3]triazol-4-yl)-benzaldehyde::CHEMBL1688775

SMILES: O=Cc1ccc(cc1)-c1c(Cc2ccccc2)nnn1CSc1ccccc1

InChI Key: InChIKey=OYMAQWCXOHAWNM-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 = 50339576   

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
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50339576 (4-(5-Benzyl-3-phenylsulfanylmethyl-3H-[1,2,3]triaz...) Show SMILES O=Cc1ccc(cc1)-c1c(Cc2ccccc2)nnn1CSc1ccccc1 Show InChI InChI=1S/C23H19N3OS/c27-16-19-11-13-20(14-12-19)23-22(15-18-7-3-1-4-8-18)24-25-26(23)17-28-21-9-5-2-6-10-21/h1-14,16H,15,17H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in human neutrophils				J Med Chem 54: 1565-75 (2011) Article DOI: 10.1021/jm101238d BindingDB Entry DOI: 10.7270/Q2SN098M
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50339576 (4-(5-Benzyl-3-phenylsulfanylmethyl-3H-[1,2,3]triaz...) Show SMILES O=Cc1ccc(cc1)-c1c(Cc2ccccc2)nnn1CSc1ccccc1 Show InChI InChI=1S/C23H19N3OS/c27-16-19-11-13-20(14-12-19)23-22(15-18-7-3-1-4-8-18)24-25-26(23)17-28-21-9-5-2-6-10-21/h1-14,16H,15,17H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of human recombinant 5-lipooxygenase expressed in Escherichia coli MV1190 by cell free assay				J Med Chem 54: 1565-75 (2011) Article DOI: 10.1021/jm101238d BindingDB Entry DOI: 10.7270/Q2SN098M
					More data for this Ligand-Target Pair
Prostaglandin E synthase 2 (Homo sapiens (Human))	BDBM50339576 (4-(5-Benzyl-3-phenylsulfanylmethyl-3H-[1,2,3]triaz...) Show SMILES O=Cc1ccc(cc1)-c1c(Cc2ccccc2)nnn1CSc1ccccc1 Show InChI InChI=1S/C23H19N3OS/c27-16-19-11-13-20(14-12-19)23-22(15-18-7-3-1-4-8-18)24-25-26(23)17-28-21-9-5-2-6-10-21/h1-14,16H,15,17H2	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of Prostaglandin E2 synthase-1 in IL-1beta stimulated microsomal fraction of human A549 cell assessed as PGE2 level by RP-HPLC				J Med Chem 54: 1565-75 (2011) Article DOI: 10.1021/jm101238d BindingDB Entry DOI: 10.7270/Q2SN098M
					More data for this Ligand-Target Pair