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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | TBXAS1 | P24557 | 15/20 | 0.50 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL1324817 | 0.89 | TBXAS1 (0.54) | ALDH1A1TBXAS1EGLN3 | |
| Lactic Acid SCHEMBL5098496 | 0.87 | TBXAS1 (0.48) | ALDH1A1TBXAS1EGLN3 | |
| Benzene SCHEMBL27671800 | 0.87 | TBXAS1 (0.47) | ALDH1A1TBXAS1EGLN3 | |
| SCHEMBL83887 | 0.87 | — | — | |
| SCHEMBL16371567 | 0.87 | TBXAS1 (0.48) | ALDH1A1TBXAS1EGLN3 | |
| Hydrochloric Acid SCHEMBL252185 | 0.85 | — | — | |
| SCHEMBL16101937 | 0.85 | — | — | |
| Iodide SCHEMBL534239 | 0.85 | — | — | |
| Bromide SCHEMBL625730 | 0.85 | — | — | |
| SCHEMBL16101936 | 0.85 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9352298-B2 | Method for producing polymer particles, and polymer particles | JSR CORPORATION (JP) | 2016-05-31 | — | — | US | disclosed |
| US-9162999-B2 | Catalytic conversion of cellulose to fuels and chemicals using boronic acids | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2015-10-20 | — | — | US | disclosed |
| US-20130316892-A1 | METHOD FOR PRODUCING POLYMER PARTICLES, AND POLYMER PARTICLES | JSR CORPORATION (JP) | 2013-11-28 | — | — | US | disclosed |
| US-20130178617-A1 | CATALYTIC CONVERSION OF CELLULOSE TO FUELS AND CHEMICALS USING BORONIC ACIDS | WISCONSIN ALUMNI RESEARCH FOUNDATION | 2013-07-11 | — | — | US | disclosed |
| WO-2013049424-A1 | CATALYTIC CONVERSION OF CELLULOSE TO FUELS AND CHEMICALS USING BORONIC ACIDS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2013-04-04 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20130178617-A1 | CATALYTIC CONVERSION OF CELLULOSE TO FUELS AND CHEMICALS USING BORONIC ACIDS | MGAM, CA2, CA6 | ALDH1A1 3895/4885TBXAS1 4165/4885EGLN3 2605/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.