Reaction Details Report a problem with these data
Target
Palmitoleoyl-protein carboxylesterase NOTUM
Ligand
BDBM29612
Substrate
n/a
Meas. Tech.
ChEMBL_2237107 (CHEMBL5151003)
IC50
93600±n/a nM
Citation
 Bayle, ED; Svensson, F; Atkinson, BN; Steadman, D; Willis, NJ; Woodward, HL; Whiting, P; Vincent, JP; Fish, PV Carboxylesterase Notum Is a Druggable Target to Modulate Wnt Signaling. J Med Chem 64:4289-4311 (2021) [PubMed] 
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:
BDBM29612
Synonyms:
CHEMBL33103 | CVD-0001578 | JOH-MSK-a63bdd1d-4 | N-ACETYL SEROTONIN | N-Acetyl-5-hydroxytryptamine | N-Acetyltryptamine,5-Hydroxy | N-acetylserotonin | Normelatonin | Serotonin,N-acetyl
Type:
Small organic molecule
Emp. Form.:
C12H14N2O2
Mol. Mass.:
218.2518
SMILES:
CC(=O)NCCc1c[nH]c2ccc(O)cc12
Structure:
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