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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CTH | P32929 | 1/20 | 0.33 |
| ▸ | CBS | P35520 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 SCHEMBL11152250 | 0.79 | TSHR (0.35) | TSHRCTHCBSTHPOTHRB | |
| Acetic Acid SCHEMBL11151335 | 0.72 | FFAR3 (0.47) | TSHRCTHCBSTHPOTHRB | |
| SCHEMBL226532 | 0.71 | — | — | |
| Acetic Acid SCHEMBL11147597 | 0.70 | TSHR (0.39) | TSHRCTHCBSTHPOTHRB | |
| SCHEMBL766382 | 0.70 | — | — | |
| SCHEMBL27132946 | 0.70 | TSHR (0.35) | TSHRCTHCBSTHPOTHRB | |
| SCHEMBL29504892 | 0.70 | TSHR (0.35) | TSHRCTHCBSTHPOTHRB | |
| Acetic Acid SCHEMBL585968 | 0.70 | TSHR (0.35) | TSHRCTHCBSTHPOTHRB | |
| SCHEMBL11149288 | 0.70 | SLC1A3 (0.39) | TSHRCTHCBSTHPOTHRB | |
| Methoxyacetic Acid SCHEMBL28383111 | 0.69 | FFAR3 (0.44) | TSHRCTHCBSTHPOTHRB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4382871-A | DICARBOXYLIC ACID ETHERS AS BUILDERS | LEVER BROTHERS COMPANY (US) | 1983-05-10 | — | — | US | disclosed |
| US-4260513-A | BUILDERS | LEVER BROTHERS COMPANY (US) | 1981-04-07 | — | — | US | disclosed |
| US-4228027-A | Detergent compositions | LEVER BROTHERS COMPANY (US) | 1980-10-14 | — | — | US | disclosed |
| US-4025450-A | OXYDIACETATE SALT BUILDER | LEVER BROTHERS COMPANY (US) | 1977-05-24 | — | — | US | disclosed |