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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL1131466 | 0.90 | TP53 (0.47) | TP53ALDH1A1TSHRNFKB1THPO | |
| Pyruvate SCHEMBL1131923 | 0.88 | TP53 (0.40) | FFAR3LCKFYNTP53ALDH1A1 | |
| Oxalic Acid SCHEMBL1131508 | 0.87 | TP53 (0.44) | TP53ALDH1A1TSHRNFKB1THPO | |
| Lactic Acid SCHEMBL1131791 | 0.84 | TP53 (0.69) | TP53ALDH1A1TSHRNFKB1THPO | |
| Methacrylic Acid SCHEMBL9365250 | 0.83 | TP53 (0.36) | FFAR3LCKFYNTP53ALDH1A1 | |
| Acetic Acid SCHEMBL297627 | 0.83 | FFAR3 (0.50) | FFAR3LCKFYNTP53ALDH1A1 | |
| SCHEMBL5944 | 0.82 | — | — | |
| SCHEMBL14112035 | 0.82 | — | — | |
| Cadaverine Tartrate SCHEMBL1131449 | 0.81 | TSHR (0.59) | TP53ALDH1A1TSHRNFKB1KDM4E | |
| Acetic Acid SCHEMBL5874694 | 0.80 | FFAR3 (0.47) | FFAR3LCKFYNTP53ALDH1A1 |
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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8784686-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2014-07-22 | — | — | US | claimed |
| EP-2414476-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. du Pont de Nemours and Company (US) | 2012-02-08 | — | — | EP | claimed |
| US-20120027661-A1 | PROCESS AND REACTOR SYSTEM FOR PRODUCING AMMONIA USING IONIC LIQUIDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-02-02 | — | — | US | claimed |
| US-20120011886-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. DU PONT DE NEMOURS AND COMPANY | 2012-01-19 | — | — | US | claimed |
| EP-1805131-B1 | IONIC LIQUIDS COMPRISING NITROGEN CONTAINING CATIONS | INNOVIA FILMS LTD (GB) | 2011-02-16 | — | — | EP | claimed |
| WO-2010117836-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-10-14 | — | — | WO | claimed |
| US-20100155660-A1 | MIXTURES OF AMMONIA AND IONIC LIQUIDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-06-24 | — | — | US | claimed |
| US-20070185330-A1 | Liquids | THE UNIVERSITY OF YORK (GB) | 2007-08-09 | — | — | US | claimed |
| EP-0410213-B2 | Microbicidal formulations and their use | BAYER AG (DE) | 1998-01-07 | — | — | EP | claimed |
| US-5190932-A | Compositions for preserving wood, textiles, leather and paper | BAYER AKTIENGESELLSCHAFT (DE) | 1993-03-02 | — | — | US | claimed |
| EP-0410213-A1 | Microbicidal formulations and their use | BAYER AG (DE) | 1991-01-30 | — | — | EP | claimed |
| US-9328220-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2016-05-03 | — | — | US | disclosed |
| US-8992798-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2015-03-31 | — | — | US | disclosed |
| US-20140286849-A1 | Mixtures of Ammonia and Ionic Liquids | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2014-09-25 | — | — | US | disclosed |
| US-8808659-B2 | Process and reactor system for producing ammonia using ionic liquids | E I DU PONT DE NEMOURS AND COMPANY (US) | 2014-08-19 | — | — | US | disclosed |
| EP-1266875-A2 | Slurry rheology modifier | Kao Corporation (JP) | 2002-12-18 | — | — | EP | disclosed |
| US-20020037975-A1 | Coated film excellent in impact, heat and corrosion resistance | YAMOTO SHUHEI (JP) | 2002-03-28 | — | — | US | disclosed |
| EP-0410213-B2 | Microbicidal formulations and their use | BAYER AG (DE) | 1998-01-07 | — | — | EP | disclosed |
| US-5190932-A | Compositions for preserving wood, textiles, leather and paper | BAYER AKTIENGESELLSCHAFT (DE) | 1993-03-02 | — | — | US | disclosed |
| EP-0410213-A1 | Microbicidal formulations and their use | BAYER AG (DE) | 1991-01-30 | — | — | EP | disclosed |