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Target
Palmitoleoyl-protein carboxylesterase NOTUM
Ligand
BDBM601015
Substrate
n/a
Meas. Tech.
ChEMBL_2252691 (CHEMBL5166901)
IC50
9.5±n/a nM
Citation
 Willis, NJ; Mahy, W; Sipthorp, J; Zhao, Y; Woodward, HL; Atkinson, BN; Bayle, ED; Svensson, F; Frew, S; Jeganathan, F; Monaghan, A; Benvegnù, S; Jolly, S; Vecchia, L; Ruza, RR; Kjær, S; Howell, S; Snijders, AP; Bictash, M; Salinas, PC; Vincent, JP; Jones, EY; Whiting, P; Fish, PV Design of a Potent, Selective, and Brain-Penetrant Inhibitor of Wnt-Deactivating Enzyme Notum by Optimization of a Crystallographic Fragment Hit. J Med Chem 65:7212-7230 (2022) [PubMed]  Article
Target
Name:
Palmitoleoyl-protein carboxylesterase NOTUM
Synonyms:
NOTUM | NOTUM_HUMAN | Palmitoleoyl-protein carboxylesterase NOTUM | hNOTUM
Type:
PROTEIN
Mol. Mass.:
55706.36
Organism:
Homo sapiens (Human)
Description:
ChEMBL_116492
Residue:
496
Sequence:
MGRGVRVLLLLSLLHCAGGSEGRKTWRRRGQQPPPPPRTEAAPAAGQPVESFPLDFTAVEGNMDSFMAQVKSLAQSLYPCSAQQLNEDLRLHLLLNTSVTCNDGSPAGYYLKESRGSRRWLLFLEGGWYCFNRENCDSRYDTMRRLMSSRDWPRTRTGTGILSSQPEENPYWWNANMVFIPYCSSDVWSGASSKSEKNEYAFMGALIIQEVVRELLGRGLSGAKVLLLAGSSAGGTGVLLNVDRVAEQLEKLGYPAIQVRGLADSGWFLDNKQYRHTDCVDTITCAPTEAIRRGIRYWNGVVPERCRRQFQEGEEWNCFFGYKVYPTLRCPVFVVQWLFDEAQLTVDNVHLTGQPVQEGLRLYIQNLGRELRHTLKDVPASFAPACLSHEIIIRSHWTDVQVKGTSLPRALHCWDRSLHDSHKASKTPLKGCPVHLVDSCPWPHCNPSCPTVRDQFTGQEMNVAQFLMHMGFDMQTVAQPQGLEPSELLGMLSNGS
  
Inhibitor
Name:
BDBM601015
Synonyms:
US11634391, Compound 277 | [1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazol-4-yl]methanol
Type:
Small organic molecule
Emp. Form.:
C10H6Cl2F3N3O
Mol. Mass.:
312.075
SMILES:
OCc1cn(nn1)-c1ccc(Cl)c(c1Cl)C(F)(F)F
Structure:
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