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 | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 3/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.44 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.44 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 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 SCHEMBL9350314 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL8676850 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL7880095 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL30992289 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL1025735 | 0.96 | — | — | |
| Acetic Acid SCHEMBL10766537 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL3389581 | 0.92 | FFAR3 (0.54) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL8064727 | 0.92 | — | — | |
| Acetic Acid SCHEMBL10944981 | 0.92 | FFAR3 (0.54) | FFAR3LCKFYNALDH1A1TDP1 | |
| Acetic Acid SCHEMBL4909754 | 0.92 | FFAR3 (0.54) | FFAR3LCKFYNALDH1A1TDP1 |
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-112023662-B | Composite desulfurizer for purifying petroleum and natural gas | 宁波中一石化科技有限公司 | 2021-07-02 | — | — | CN | disclosed |
| CN-112023662-A | Composite desulfurizer for purifying petroleum and natural gas | 宁波中一石化科技有限公司 | 2020-12-04 | — | — | CN | disclosed |