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.
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 SCHEMBL11518561 | 1.00 | CA5A (0.57) | — | |
| Acetic Acid SCHEMBL10884476 | 1.00 | CA5A (0.57) | — | |
| Acetic Acid SCHEMBL11518558 | 1.00 | CA5A (0.57) | — | |
| Acetic Acid SCHEMBL17389362 | 1.00 | CA5A (0.57) | — | |
| Acetic Acid SCHEMBL11518569 | 0.97 | CA5A (0.53) | — | |
| Acetic Acid SCHEMBL78900 | 0.96 | — | — | |
| Acetic Acid SCHEMBL3457294 | 0.96 | CA5A (0.61) | — | |
| Acetic Acid SCHEMBL28587428 | 0.96 | CA5A (0.61) | — | |
| Acetic Acid SCHEMBL7667976 | 0.96 | CA5A (0.61) | — | |
| Acetic Acid SCHEMBL8350356 | 0.96 | CA5A (0.61) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140033920-A1 | ENHANCED PARTIALLY-AMINATED METAL-ORGANIC FRAMEWORKS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-02-06 | — | — | US | disclosed |
| WO-2012115890-A2 | ENHANCED PARTIALLY-AMINATED METAL-ORGANIC FRAMEWORKS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-08-30 | — | — | WO | disclosed |