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 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HMGCR | P04035 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 SCHEMBL27552677 | 1.00 | FFAR3 (0.47) | FFAR3LCKFYNALDH1A1TSHR | |
| Amylene Hydrate SCHEMBL6302374 | 0.87 | FFAR3 (0.47) | FFAR3LCKFYNALDH1A1TSHR | |
| Methacrylic Acid SCHEMBL27402548 | 0.83 | TET2 (0.43) | FFAR3LCKFYNALDH1A1TSHR | |
| Methacrylic Acid SCHEMBL2234573 | 0.83 | TET2 (0.43) | FFAR3LCKFYNALDH1A1TSHR | |
| Methacrylic Acid SCHEMBL28304977 | 0.83 | TET2 (0.43) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL3444362 | 0.83 | TSHR (0.57) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL28164603 | 0.83 | TSHR (0.57) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL3711197 | 0.83 | FFAR3 (0.50) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL8189186 | 0.83 | FFAR3 (0.50) | FFAR3LCKFYNALDH1A1TSHR | |
| SCHEMBL9930783 | 0.82 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104136548-B | Silver ion diffusion inhibition layer formation constituent, silver ion diffusion inhibition layer film and its application | 富士胶片株式会社 | 2017-03-08 | — | — | CN | disclosed |
| CN-104046131-B | Jetted ink, use the print cartridge of this ink, ink mist recording instrument and ink recorded matter | 株式会社理光 | 2016-06-29 | — | — | CN | disclosed |
| CN-104364717-A | Method of producing electrophotographic photosensitive member | CANON KK | 2015-02-18 | — | — | CN | disclosed |