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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8255750 | 0.77 | — | — | |
| SCHEMBL1190684 | 0.77 | — | — | |
| SCHEMBL119178 | 0.77 | — | — | |
| SCHEMBL8005094 | 0.77 | — | — | |
| Acetic Acid SCHEMBL28981567 | 0.73 | CA1 (0.73) | CA1CA4FFAR3LCKFYN | |
| Acetic Acid SCHEMBL29157117 | 0.73 | CA1 (0.89) | CA1CA4FFAR3LCKFYN | |
| Acetic Acid SCHEMBL170537 | 0.73 | CA1 (0.89) | CA1CA4FFAR3LCKFYN | |
| Acetic Acid SCHEMBL1024877 | 0.73 | CA1 (0.89) | CA1CA4FFAR3LCKFYN | |
| Acetic Acid SCHEMBL11574110 | 0.70 | — | — | |
| Acetic Acid SCHEMBL9418227 | 0.69 | CA1 (0.80) | CA1CA4FFAR3LCKFYN |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5254632-A | Method of manufacturing polyalkyl methacrylate macromonomers, and use of same in the manufacture of comb polymers | ROHM GMBH CHEMISCHE FABRIK (DE) | 1993-10-19 | — | — | US | disclosed |