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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.33 |
| ▸ | MC4R known ✓ | P32245 | 1/20 | 0.33 |
| ▸ | OPRK1 known ✓ | P41145 | 1/20 | 0.33 |
| ▸ | SCN5A known ✓ | Q14524 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 2/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
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 SCHEMBL3927926 | 1.00 | FYN (0.41) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Acetic Acid SCHEMBL3841810 | 1.00 | FYN (0.41) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Diethanolamine SCHEMBL502768 | 0.97 | FFAR3 (0.44) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Diethanolamine SCHEMBL9790976 | 0.97 | FFAR3 (0.44) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Diethanolamine SCHEMBL11454426 | 0.94 | FFAR3 (0.41) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Diethanolamine SCHEMBL29053961 | 0.94 | FFAR3 (0.41) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Diethanolamine SCHEMBL3630770 | 0.94 | FFAR3 (0.41) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Acetic Acid SCHEMBL7158387 | 0.90 | CYP2C19 (0.42) | FYNFFAR3LCKSMN1; SMN2KDM4E | |
| Acetic Acid SCHEMBL3930945 | 0.88 | CA12 (0.50) | KDM4EALDH1A1MEN1KMT2APAOX | |
| Acetic Acid SCHEMBL29035918 | 0.88 | CA12 (0.50) | KDM4EALDH1A1MEN1KMT2APAOX |
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 |
|---|---|---|---|---|---|---|---|
| US-20090127501-A1 | Polishing Composition for Silicon Wafer | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2009-05-21 | — | — | US | claimed |
| US-20090127501-A1 | Polishing Composition for Silicon Wafer | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2009-05-21 | — | — | US | disclosed |