Reaction Details Report a problem with these data
Target
N-acylethanolamine-hydrolyzing acid amidase
Ligand
BDBM393327
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
>1000±n/a nM
Citation
 Malamas, M; Makriyannis, A; Subramanian, KV; Whitten, KM; Zvonok, NM; West, JM; Mccormack, M; Pavlopoulos, S N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and their use thereof US Patent  US9963444 Publication Date 5/8/2018 
Target
Name:
N-acylethanolamine-hydrolyzing acid amidase
Synonyms:
ASAH-like protein | ASAHL | Acid ceramidase-like protein | N-acylethanolamine-hydrolyzing acid amidase | N-acylsphingosine amidohydrolase-like | N-acylsphingosine-amidohydrolase | NAAA | NAAA_HUMAN | PLT
Type:
Enzyme
Mol. Mass.:
40073.12
Organism:
Homo sapiens (Human)
Description:
Q02083
Residue:
359
Sequence:
MRTADREARPGLPSLLLLLLAGAGLSAASPPAAPRFNVSLDSVPELRWLPVLRHYDLDLVRAAMAQVIGDRVPKWVHVLIGKVVLELERFLPQPFTGEIRGMCDFMNLSLADCLLVNLAYESSVFCTSIVAQDSRGHIYHGRNLDYPFGNVLRKLTVDVQFLKNGQIAFTGTTFIGYVGLWTGQSPHKFTVSGDERDKGWWWENAIAALFRRHIPVSWLIRATLSESENFEAAVGKLAKTPLIADVYYIVGGTSPREGVVITRNRDGPADIWPLDPLNGAWFRVETNYDHWKPAPKEDDRRTSAIKALNATGQANLSLEALFQILSVVPVYNNFTIYTTVMSAGSPDKYMTRIRNPSRK
  
Inhibitor
Name:
BDBM393327
Synonyms:
4-(((1R,3R)-3-isothiocyanatocyclobutoxy)methyl)-1,1'-biphenyl | US9963444, Example 30
Type:
Small organic molecule
Emp. Form.:
C18H17NOS
Mol. Mass.:
295.399
SMILES:
S=C=N[C@H]1C[C@@H](C1)OCc1ccc(cc1)-c1ccccc1 |r,wU:5.7,wD:3.2,(8.28,4.39,;6.94,3.62,;5.61,2.85,;4.28,2.08,;2.79,2.48,;2.39,1,;3.88,.6,;1.06,.23,;-.28,1,;-1.61,.23,;-1.61,-1.31,;-2.94,-2.08,;-4.28,-1.31,;-4.28,.23,;-2.94,1,;-5.61,-2.08,;-6.94,-1.31,;-8.28,-2.08,;-8.28,-3.62,;-6.94,-4.39,;-5.61,-3.62,)|
Structure:
Search PDB for entries with ligand similarity: