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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ARG1 | P05089 | 1/20 | 0.38 |
| ▸ | CDC25A | P30304 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL28952653 | 1.00 | SMN1; SMN2 (0.49) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL29906127 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL27925787 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL29906137 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL29906144 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL27849754 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| SCHEMBL27700941 | 0.93 | TLR8 (0.54) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| Hydrochloric Acid SCHEMBL28836326 | 0.91 | TLR8 (0.55) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| Hydrochloric Acid SCHEMBL27943012 | 0.91 | TLR8 (0.55) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A | |
| Sulfuric Acid SCHEMBL31037631 | 0.89 | TLR8 (0.48) | SMN1; SMN2TLR8ALDH1A1POLBKMT2A |
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-114989406-B | Application of non-metal organic compound in DMT method for synthesizing polyester, DMT method functional copolyester and preparation method thereof | 青岛大学 | 2024-01-12 | — | — | CN | disclosed |