BDBM50182298 7-((3-fluoro-5-((1S,3S,5R)-3-hydroxy-6,8-dioxa-bicyclo[3.2.1]octan-3-yl)phenoxy)methyl)-4-phenyl-2H-chromen-2-one::CHEMBL204781
SMILES: O[C@]1(C[C@H]2CO[C@@H](C1)O2)c1cc(F)cc(OCc2ccc3c(cc(=O)oc3c2)-c2ccccc2)c1
InChI Key: InChIKey=MRUZHPQFENMWTJ-SUIMDOTNSA-N
Data: 3 IC50
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)) | BDBM50182298 (7-((3-fluoro-5-((1S,3S,5R)-3-hydroxy-6,8-dioxa-bic...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL | Assay Description Inhibition of human 5-LO | Bioorg Med Chem Lett 16: 2528-31 (2006) Article DOI: 10.1016/j.bmcl.2006.01.085 BindingDB Entry DOI: 10.7270/Q2NV9HVZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Arachidonate 5-lipoxygenase (Homo sapiens (Human)) | BDBM50182298 (7-((3-fluoro-5-((1S,3S,5R)-3-hydroxy-6,8-dioxa-bic...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL | Assay Description Inhibition of LTB4 production in calcium ionophore A-23187-stimulated human polymorphonuclear leukocyte | Bioorg Med Chem Lett 16: 2528-31 (2006) Article DOI: 10.1016/j.bmcl.2006.01.085 BindingDB Entry DOI: 10.7270/Q2NV9HVZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Arachidonate 5-lipoxygenase (Homo sapiens (Human)) | BDBM50182298 (7-((3-fluoro-5-((1S,3S,5R)-3-hydroxy-6,8-dioxa-bic...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 440 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL | Assay Description Inhibition of LTB4 production in calcium ionophore A23187-stimulated human whole blood | Bioorg Med Chem Lett 16: 2528-31 (2006) Article DOI: 10.1016/j.bmcl.2006.01.085 BindingDB Entry DOI: 10.7270/Q2NV9HVZ | |||||||||||
More data for this Ligand-Target Pair |