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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9850474 | 0.72 | SLC18A3 (0.54) | SLC18A3 | |
| SCHEMBL2855802 | 0.71 | ALOX15 (0.42) | ALOX15 | |
| SCHEMBL23675872 | 0.70 | CYP2C9 (0.41) | TACR3CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL7079848 | 0.69 | SLC6A2 (0.47) | TACR3 | |
| SCHEMBL2856289 | 0.69 | LMNA (0.51) | SLC18A3TACR3ALOX15 | |
| SCHEMBL7806032 | 0.69 | SLC6A2 (0.47) | TACR3 | |
| SCHEMBL7078988 | 0.69 | SLC6A2 (0.47) | TACR3 | |
| SCHEMBL3026559 | 0.68 | CYP2C9 (0.67) | TACR3CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL18620100 | 0.68 | TACR3 (0.71) | TACR3CYP2C9CYP2C19HTR2BMAPK14 | |
| SCHEMBL22388742 | 0.68 | SMN1; SMN2 (0.48) | CYP2C19 |
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-4034095-A | ANTIDEPRESSANT, ANTICHOLINERGIC | SANDOZ LTD. (CH) | 1977-07-05 | — | — | US | disclosed |