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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 SCHEMBL7527682 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL21806304 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL6238375 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL300016 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL10630506 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL10637065 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL1238242 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL1695866 | 0.92 | FFAR3 (0.54) | FFAR3LCKFYNTP53SLC7A5 | |
| Acetic Acid SCHEMBL4894483 | 0.92 | FFAR3 (0.54) | FFAR3LCKFYNTP53SLC7A5 | |
| SCHEMBL11705862 | 0.92 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102010321-B | Process for continuously producing isobutyric acid | YIXING HENGXING FINE CHEMICAL CO LTD | 2013-10-23 | — | — | CN | disclosed |
| CN-102010321-A | Process for continuously producing isobutyric acid | YIXING HENGXING FINE CHEMICAL CO LTD | 2011-04-13 | — | — | CN | disclosed |