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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7659517 | 0.98 | MAPT (0.36) | MAPTMEN1ALDH1A1KMT2AASH1L | |
| Acetic Acid SCHEMBL7815326 | 0.90 | MAPT (0.41) | MAPTMEN1ALDH1A1KMT2AASH1L | |
| Acetic Acid SCHEMBL8366763 | 0.89 | MAPT (0.38) | MAPTMEN1KMT2AASH1LTDP1 | |
| Acetic Acid SCHEMBL7665427 | 0.89 | MAPT (0.33) | MAPTALDH1A1KMT2AASH1L | |
| Acetic Acid SCHEMBL7657005 | 0.88 | MAPT (0.37) | MAPTMEN1KMT2AASH1LTDP1 | |
| Acetic Acid SCHEMBL7817159 | 0.88 | MAPT (0.37) | MAPTALDH1A1ASH1LTDP1 | |
| Acetic Acid SCHEMBL7663687 | 0.88 | MAPT (0.41) | MAPTMEN1KMT2AASH1LTDP1 | |
| Acetic Acid SCHEMBL7656468 | 0.87 | CYP1A2 (0.40) | MAPTMEN1KMT2AASH1LTDP1 | |
| Acetic Acid SCHEMBL7659518 | 0.87 | MAPT (0.35) | MAPTMEN1KMT2AASH1LTDP1 | |
| Acetic Acid SCHEMBL7820632 | 0.87 | MAPT (0.39) | MAPTMEN1ALDH1A1KMT2AASH1L |
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-6458792-B1 | MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, IMMUNOLOGICAL, BRONCHOPULMONARY, CARDIOVASCULAR, ONCOLOGICAL OR CNS-DEGENERATIVE DISORDERS. | ASTRAZENECA AB (SE) | 2002-10-01 | — | — | US | disclosed |