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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 7/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL30679254 | 0.87 | DNM1 (0.44) | CA1CA2DNM1 | |
| Hydrochloric Acid SCHEMBL623778 | 0.85 | DNM1 (0.42) | CA1CA2DNM1 | |
| Benzoic Acid SCHEMBL1685233 | 0.81 | CA2 (0.42) | CA2MAPK1CYP3A4 | |
| Acetic Acid SCHEMBL123876 | 0.78 | DNM1 (0.55) | CA1CA2DNM1MAPK1NFKB1 | |
| Acetic Acid SCHEMBL329012 | 0.78 | DNM1 (0.55) | CA1CA2DNM1MAPK1NFKB1 | |
| Acetic Acid SCHEMBL7563930 | 0.76 | DNM1 (0.52) | CA1CA2DNM1MAPK1NFKB1 | |
| Acetic Acid SCHEMBL11661247 | 0.74 | DNM1 (0.50) | CA1CA2DNM1MAPK1NFKB1 | |
| Acetic Acid SCHEMBL11408206 | 0.74 | DNM1 (0.50) | CA1CA2DNM1MAPK1NFKB1 | |
| Acetic Acid SCHEMBL7607588 | 0.74 | DNM1 (0.64) | CA1CA2DNM1NFKB1 | |
| Acetic Acid SCHEMBL329011 | 0.74 | DNM1 (0.50) | CA1CA2DNM1MAPK1NFKB1 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050154145-A1 | Fluoropolymer compositions | 3M INNOVATIVE PROPERTIES COMPANY | 2005-07-14 | — | — | US | claimed |
| EP-1379565-B1 | FLUOROPOLYMER COMPOSITIONS | 3M INNOVATIVE PROPERTIES CO (US) | 2011-04-06 | — | — | EP | disclosed |
| US-20050154145-A1 | Fluoropolymer compositions | 3M INNOVATIVE PROPERTIES COMPANY | 2005-07-14 | — | — | US | disclosed |
| US-6890995-B2 | Fluoropolymer compositions | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-05-10 | — | — | US | disclosed |
| US-6844388-B2 | Fluoropolymer compositions containing a nitrogen cure site monomer | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-01-18 | — | — | US | disclosed |
| EP-1379565-A1 | FLUOROPOLYMER COMPOSITIONS | 3M Innovative Properties Company (US) | 2004-01-14 | — | — | EP | disclosed |
| EP-1366094-A1 | FLUOROPOLYMER COMPOSITIONS | 3M Innovative Properties Company (US) | 2003-12-03 | — | — | EP | disclosed |
| US-20020177666-A1 | Fluoropolymer compositions | 3M INNOVATIVE PROPERTIES COMPANY | 2002-11-28 | — | — | US | disclosed |
| WO-2002083756-A1 | FLUOROPOLYMER COMPOSITIONS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2002-10-24 | — | — | WO | disclosed |
| US-20020145228-A1 | Fluoropolymer compositions | 3M INNOVATIVE PROPERTIES COMPANY | 2002-10-10 | — | — | US | disclosed |
| WO-2002060969-A1 | FLUOROPOLYMER COMPOSITIONS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2002-08-08 | — | — | WO | disclosed |