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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
| ▸ | GABRE | P78334 | 2/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL18224038 | 0.91 | ALDH1A1 (0.48) | ALDH1A1ALOX15GABRPGABRDGABRA1 | |
| Acetic Acid SCHEMBL4950098 | 0.90 | ALOX15 (0.50) | ALDH1A1ALOX15FFAR3LCKFYN | |
| SCHEMBL5836657 | 0.86 | ALDH1A1 (0.44) | ALDH1A1ALOX15GABRPGABRDGABRA1 | |
| Methacrylic Acid SCHEMBL19664263 | 0.85 | ALDH1A1 (0.45) | ALDH1A1ALOX15GABRPGABRDGABRA1 | |
| Methacrylic Acid SCHEMBL496660 | 0.85 | ALDH1A1 (0.45) | ALDH1A1ALOX15GABRPGABRDGABRA1 | |
| Methacrylic Acid SCHEMBL19664272 | 0.85 | ALDH1A1 (0.45) | ALDH1A1ALOX15GABRPGABRDGABRA1 | |
| SCHEMBL28762 | 0.84 | — | — | |
| Malonic Acid SCHEMBL30288558 | 0.83 | LDHA (0.47) | ALDH1A1ALOX15FFAR3GABRPGABRD | |
| Propionic Acid SCHEMBL29086888 | 0.83 | FFAR3 (0.53) | ALDH1A1ALOX15FFAR3GABRPGABRD | |
| Succinic Acid SCHEMBL28289303 | 0.83 | GABRP (0.54) | ALDH1A1ALOX15FFAR3GABRPGABRD |
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 |
|---|---|---|---|---|---|---|---|
| US-6255276-B1 | MUSK MACROMOLECULE | GIVAUDEN ROURE (INTERNATIONAL) S.A. (CH) | 2001-07-03 | — | — | US | disclosed |