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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 3/20 | 0.33 |
| ▸ | CES1 | P23141 | 3/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 SCHEMBL8750095 | 0.86 | ALDH1A1 (0.36) | TDP1PGRSCN1ASCN2ASCN3A | |
| Acetic Acid SCHEMBL2170904 | 0.86 | ALDH1A1 (0.36) | TDP1PGRSCN1ASCN2ASCN3A | |
| Phosphoric Acid SCHEMBL9067731 | 0.84 | ACP3 (0.34) | SLC6A2SLC6A4SLC6A3TDP1HPGD | |
| Acetic Acid SCHEMBL8750075 | 0.83 | HPGD (0.34) | TDP1HPGDALDH1A1ERCC5FEN1 | |
| Acetic Acid SCHEMBL7200704 | 0.83 | ERCC5 (0.38) | TDP1HPGDALDH1A1ERCC5FEN1 | |
| Acetic Acid SCHEMBL7194036 | 0.81 | ERCC5 (0.34) | TDP1HPGDALDH1A1ERCC5FEN1 | |
| Acetic Acid SCHEMBL8750049 | 0.78 | POLB (0.44) | TDP1HPGDALDH1A1LMNAMAPT | |
| Acetic Acid SCHEMBL1033265 | 0.77 | ALDH1A1 (0.41) | TDP1HPGDALDH1A1ERCC5FEN1 | |
| Acetic Acid SCHEMBL7197002 | 0.77 | POLB (0.42) | TDP1HPGDALDH1A1LMNAMAPT | |
| Acetic Acid SCHEMBL9603313 | 0.77 | TSHR (0.55) | SLC6A3TDP1ALDH1A1MAPTCES2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5534565-A | DICYANDIAMIDE DERIVATIVES FOR LAMINATES | ALLIEDSIGNAL INC. (US) | 1996-07-09 | — | — | US | disclosed |