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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | OR51E2 | Q9H255 | 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 | |
|---|---|---|---|---|
| SCHEMBL2388150 | 0.80 | — | — | |
| Acetic Acid SCHEMBL1409006 | 0.77 | — | — | |
| Tetrafluoroethylene SCHEMBL28004090 | 0.73 | FFAR3 (0.64) | FFAR3LCKFYN | |
| Acetic Acid SCHEMBL8780995 | 0.70 | — | — | |
| Glycolic Acid SCHEMBL2126630 | 0.70 | — | — | |
| Acetic Acid SCHEMBL28703224 | 0.70 | FFAR3 (0.58) | FFAR3LCKFYNOR51E2 | |
| Glycolic Acid SCHEMBL8054489 | 0.70 | FFAR3 (0.58) | FFAR3LCKFYNOR51E2 | |
| Acetic Acid SCHEMBL1344848 | 0.69 | — | — | |
| Acetic Acid SCHEMBL27145923 | 0.69 | — | — | |
| Acetic Acid SCHEMBL27496916 | 0.69 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8518294-B2 | Compositions comprising 2,3,3,3-tetrafluoropropene, 2-chloro-2,3,3,3-tetrafluoropropanol, 2-chloro-2,3,3,3-tetrafluoro-propyl acetate or zinc (2-chloro-2,3,3,3-tetrafluoropropdxy) chloride | E I DU PONT DE NEMOURS AND COMPANY (US) | 2013-08-27 | — | — | US | disclosed |
| US-8299309-B2 | Synthesis of hydrofluoroalkanols and hydrofluoroalkenes | E I DU PONT DE NEMOURS AND COMPANY (US) | 2012-10-30 | — | — | US | disclosed |
| US-20120168672-A1 | COMPOSITIONS COMPRISING 2,3,3,3-TETRAFLUOROPROPENE, 2-CHLORO-2,3,3,3-TETRAFLUOROPROPANOL, 2-CHLORO-2,3,3,3-TETRAFLUORO-PROPYL ACETATE OR ZINC (2-CHLORO-2,3,3,3-TETRAFLUOROPROPOXY) CHLORIDE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-07-05 | — | — | US | disclosed |
| US-20120083619-A1 | Synthesis of Hydrofluoroalkanols and Hydrofluoroalkenes | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-04-05 | — | — | US | disclosed |
| US-8147710-B2 | Compositions comprising 2,3,3,3-tetrafluoropropene, 2-chloro-2,3,3,3-tetrafluoropropanol, 2-chloro-2,3,3,3-tetrafluoro-propyl acetate or zinc (2-chloro-2,3,3,3-tetrafluoropropoxy) chloride | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-04-03 | — | — | US | disclosed |
| US-8058488-B2 | Synthesis of hydrofluoroalkanols and hydrofluoroalkenes | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-11-15 | — | — | US | disclosed |
| US-20100090156-A1 | COMPOSITIONS COMPRISING 2,3,3,3-TETRAFLUOROPROPENE, 2-CHLORO-2,3,3,3-TETRAFLUOROPROPANOL, 2-CHLORO-2,3,3,3-TETRAFLUORO-PROPYL ACETATE OR ZINC (2-CHLORO-2,3,3,3-TETRAFLUOROPROPOXY) CHLORIDE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-04-15 | — | — | US | disclosed |
| US-20090143604-A1 | Synthesis of hydrofluoroalkanols and hydrofluoroalkenes | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-06-04 | — | — | US | disclosed |