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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | TGM2 | P21980 | 1/20 | 0.35 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10340521 | 0.84 | ELANE (0.45) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL26092904 | 0.82 | AKR1C3 (0.46) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL27740973 | 0.81 | CYP19A1 (0.40) | ELANEALDH1A1MAPTGAAATM | |
| SCHEMBL28166141 | 0.81 | ALDH1A1 (0.44) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL165007 | 0.80 | ELANE (0.47) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL4324963 | 0.80 | ELANE (0.47) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL809326 | 0.80 | ELANE (0.47) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL18677582 | 0.79 | ELANE (0.41) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| Diphenyl Ethanedioat SCHEMBL27942895 | 0.79 | ELANE (0.53) | ELANEALDH1A1MAPTHSP90AA1GAA | |
| SCHEMBL22738431 | 0.79 | ELANE (0.49) | ELANEALDH1A1MAPTHSP90AA1GAA |
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-107531978-A | Methacrylic resin composition | 株式会社可乐丽 | 2018-01-02 | — | — | CN | disclosed |
| CN-106414599-A | Methacrylic resin composition | 株式会社可乐丽 | 2017-02-15 | — | — | CN | disclosed |