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 | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 3/20 | 0.40 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.30 |
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 SCHEMBL4395305 | 1.00 | CA1 (0.44) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL16669322 | 0.97 | CA1 (0.47) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL1501532 | 0.94 | CA1 (0.50) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL16669154 | 0.94 | CA1 (0.50) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL27969590 | 0.87 | CA2 (0.48) | CA1CA4 | |
| Acetic Acid SCHEMBL28193583 | 0.86 | FFAR3 (0.41) | CA1CA4 | |
| Acetic Acid SCHEMBL27895513 | 0.85 | CA2 (0.46) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL4395302 | 0.83 | CA1 (0.44) | CA1CA4FAHD1 | |
| Acetic Acid SCHEMBL28569287 | 0.82 | CA2 (0.48) | CA1 | |
| Ethaneperoxoic Acid SCHEMBL27953538 | 0.81 | POLB (0.35) | CA4 |
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-7927508-B2 | Composition and process for enhanced sanitation and oxidation of aqueous systems | TRUOX, INC. (US) | 2011-04-19 | — | — | US | disclosed |
| US-7794607-B2 | Composition and method for enhanced sanitation and oxidation of aqueous systems | TRUOX, INC. (US) | 2010-09-14 | — | — | US | disclosed |
| US-20090304810-A1 | Composition and method for enhanced sanitation and oxidation of aqueous systems | TRUOX, INC. | 2009-12-10 | — | — | US | disclosed |
| US-20090145857-A1 | Composition and process for enhanced sanitation and oxidation of aqueous systems | TRUOX, INC. | 2009-06-11 | — | — | US | disclosed |
| US-20070193958-A1 | Composition and method for enhanced sanitation and oxidation of aqueous systems | TRUOX, INC. (US) | 2007-08-23 | — | — | US | disclosed |