Molecule Details
InChIKeyQAOAOVKBIIKRNL-UHFFFAOYSA-N
Compound NameMK 886
Canonical SMILESCC(C)c1ccc2c(c1)c(SC(C)(C)C)c(CC(C)(C)C(=O)O)n2Cc1ccc(Cl)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.74
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB16739
Drug NameMK-886
CAS Number118414-82-7
Groups experimental
ATC Codes nan
DescriptionMK-886 is an experimental inhibitor of leukotriene synthesis.

Categories: Benzene Derivatives Enzyme Inhibitors Heterocyclic Compounds, Fused-Ring Hydrocarbons, Chlorinated Hydrocarbons, Halogenated Lipoxygenase Inhibitors PPAR alpha, antagonists & inhibitors
Cross-references: BindingDB: 50006805 ChEBI: 75390 CHEMBL29097 ChemSpider: 2885052 PDB: QY7 Wikipedia: MK-886 ZINC: ZINC000001536875
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O14684 PTGES Homo sapiens Human PF01124 8.5 IC50 BindingDB
P20292 ALOX5AP Homo sapiens Human PF01124 7.6 IC50 ChEMBL;BindingDB
P09917 ALOX5 Homo sapiens Human PF00305 PF01477 7.0 IC50 ChEMBL;BindingDB
DrugBank Target Actions (2)
Target Gene Target Name Action Type
P20292 ALOX5AP Arachidonate 5-lipoxygenase-activating protein inhibitor targets
P09917 ALOX5 Polyunsaturated fatty acid 5-lipoxygenase modulator targets