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 SCHEMBL9773855 | 1.00 | FFAR3 (0.50) | — | |
| Acetic Acid SCHEMBL1653501 | 1.00 | FFAR3 (0.50) | — | |
| Bicarbonate SCHEMBL28062055 | 0.85 | — | — | |
| Methacrylic Acid SCHEMBL15259568 | 0.84 | TDP1 (0.38) | — | |
| Acetic Acid SCHEMBL25333160 | 0.81 | FFAR3 (0.54) | — | |
| Acetic Acid SCHEMBL973954 | 0.81 | FFAR3 (0.54) | — | |
| Acetic Acid SCHEMBL21961942 | 0.81 | FFAR3 (0.54) | — | |
| Acetic Acid SCHEMBL28070973 | 0.81 | FFAR3 (0.54) | — | |
| Acetic Acid SCHEMBL7784606 | 0.81 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL1578192 | 0.81 | FFAR3 (0.64) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103917231-B | Combination formulations of histone deacetylase inhibitor and bendamustine and application thereof | 药品循环有限责任公司 | 2016-09-28 | — | — | CN | disclosed |