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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | N-acylethanolamine-hydrolyzing acid amidase | ||
| Ligand | BDBM50576137 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2126462 (CHEMBL4835807) | ||
| IC50 | 4.5±n/a nM | ||
| Citation |  Malamas, MS; Pavlopoulos, S; Alapafuja, SO; Farah, SI; Zvonok, A; Mohammad, KA; West, J; Perry, NT; Pelekoudas, DN; Rajarshi, G; Shields, C; Chandrashekhar, H; Wood, J; Makriyannis, A Design and Structure-Activity Relationships of Isothiocyanates as Potent and Selective J Med Chem64:5956-5972 (2021) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| N-acylethanolamine-hydrolyzing acid amidase | |||
| 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: |
| ||
| BDBM50576137 | |||
| n/a | |||
| Name | BDBM50576137 | ||
| Synonyms: | CHEMBL4863412 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C20H18FNO2S | ||
| Mol. Mass. | 355.426 | ||
| SMILES | Fc1cc(ccc1CO[C@H]1C[C@H](C1)N=C=S)-c1ccc2OCCc2c1 |r,wU:9.9,11.14,(13.46,-17.55,;12.7,-18.88,;11.16,-18.9,;10.4,-20.24,;11.19,-21.57,;12.73,-21.55,;13.49,-20.22,;15.02,-20.2,;15.81,-21.53,;17.35,-21.52,;18.42,-20.42,;19.52,-21.5,;18.44,-22.59,;21.06,-21.48,;21.84,-22.81,;22.6,-24.13,;8.86,-20.26,;8.09,-18.93,;6.55,-18.94,;5.78,-20.28,;4.27,-20.63,;4.13,-22.17,;5.56,-22.78,;6.58,-21.61,;8.12,-21.59,)| | ||
| Structure | 
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