Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 6/20 | 0.59 |
| ▸ | CASP2 | P42575 | 1/20 | 0.56 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.54 |
| ▸ | NAAA | Q02083 | 1/20 | 0.53 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.53 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 3/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10065860 | 0.94 | FAAH (0.65) | FAAHCASP2DNM1EPHX2NAAA | |
| SCHEMBL29637718 | 0.94 | FAAH (0.65) | FAAHCASP2DNM1EPHX2NAAA | |
| SCHEMBL29637700 | 0.94 | FAAH (0.65) | FAAHCASP2DNM1EPHX2NAAA | |
| SCHEMBL14023079 | 0.94 | FAAH (0.65) | FAAHCASP2DNM1EPHX2NAAA | |
| SCHEMBL4391096 | 0.94 | FAAH (0.65) | FAAHCASP2DNM1EPHX2NAAA | |
| SCHEMBL6684491 | 0.93 | FAAH (0.61) | FAAHCASP2DNM1EPHX2NAAA | |
| Propionic Acid SCHEMBL29046289 | 0.91 | FAAH (0.57) | FAAHCASP2DNM1EPHX2NAAA | |
| Propionic Acid SCHEMBL28737135 | 0.91 | FAAH (0.57) | FAAHCASP2DNM1EPHX2NAAA | |
| Propionic Acid SCHEMBL28737149 | 0.91 | FAAH (0.57) | FAAHCASP2DNM1EPHX2NAAA | |
| Propionic Acid SCHEMBL28737126 | 0.91 | FAAH (0.57) | FAAHCASP2DNM1EPHX2NAAA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114478476-B | Tetrahydronaphthalene compounds, pharmaceutical composition and application thereof | 广州市恒诺康医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |