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Target
Polyunsaturated fatty acid 5-lipoxygenase
Ligand
BDBM50468866
Substrate
n/a
Meas. Tech.
ChEMBL_1801306 (CHEMBL4273598)
IC50
1700±n/a nM
Citation
 Cheung, SY; Werner, M; Esposito, L; Troisi, F; Cantone, V; Liening, S; König, S; Gerstmeier, J; Koeberle, A; Bilancia, R; Rizza, R; Rossi, A; Roviezzo, F; Temml, V; Schuster, D; Stuppner, H; Schubert-Zsilavecz, M; Werz, O; Hanke, T; Pace, S Discovery of a benzenesulfonamide-based dual inhibitor of microsomal prostaglandin E Eur J Med Chem 156:815-830 (2018) [PubMed]  Article 
Target
Name:
Polyunsaturated fatty acid 5-lipoxygenase
Synonyms:
5-LO | 5-Lipo-oxygenase (5-LOX) | 5-Lipoxygenase (5-LO) | 5-Lipoxygenase (LOX) | 5-Lipoygenase | LOX5_HUMAN | ALOX5 | LOG5 | 5-lipoxygenase/FLAP | Arachidonate 5-lipoxygenase
Type:
Enzyme
Mol. Mass.:
77972.74
Organism:
Human
Description:
Recombinant protein was purified from E. coli lysate. After ammonium sulfate precipitation and subsequent steps, the supernatant (S100) was used for 5-LO activity assay.
Residue:
674
Sequence:
MPSYTVTVATGSQWFAGTDDYIYLSLVGSAGCSEKHLLDKPFYNDFERGAVDSYDVTVDEELGEIQLVRIEKRKYWLNDDWYLKYITLKTPHGDYIEFPCYRWITGDVEVVLRDGRAKLARDDQIHILKQHRRKELETRQKQYRWMEWNPGFPLSIDAKCHKDLPRDIQFDSEKGVDFVLNYSKAMENLFINRFMHMFQSSWNDFADFEKIFVKISNTISERVMNHWQEDLMFGYQFLNGCNPVLIRRCTELPEKLPVTTEMVECSLERQLSLEQEVQQGNIFIVDFELLDGIDANKTDPCTLQFLAAPICLLYKNLANKIVPIAIQLNQIPGDENPIFLPSDAKYDWLLAKIWVRSSDFHVHQTITHLLRTHLVSEVFGIAMYRQLPAVHPIFKLLVAHVRFTIAINTKAREQLICECGLFDKANATGGGGHVQMVQRAMKDLTYASLCFPEAIKARGMESKEDIPYYFYRDDGLLVWEAIRTFTAEVVDIYYEGDQVVEEDPELQDFVNDVYVYGMRGRKSSGFPKSVKSREQLSEYLTVVIFTASAQHAAVNFGQYDWCSWIPNAPPTMRAPPPTAKGVVTIEQIVDTLPDRGRSCWHLGAVWALSQFQENELFLGMYPEEHFIEKPVKEAMARFRKNLEAIVSVIAERNKKKQLPYYYLSPDRIPNSVAI
  
Inhibitor
Name:
BDBM50468866
Synonyms:
CHEMBL4287883
Type:
Small organic molecule
Emp. Form.:
C31H23NO3
Mol. Mass.:
457.53
SMILES:
OC(=O)c1ccc(cc1)N(Cc1ccc2ccccc2c1)C(=O)c1ccc(cc1)-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: