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 | |
|---|---|---|---|---|
| ▸ | SSTR3 known ✓ | P32745 | 1/20 | 0.41 |
| ▸ | Q9HBH1 | 1/20 | 0.44 | |
| ▸ | NTMT1 | Q9BV86 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 11/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 9/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 9/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 9/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL263537 | 0.98 | PDF (0.46) | PDFNTMT1F2PRSS1PRSS2 | |
| SCHEMBL29427848 | 0.98 | PDF (0.46) | PDFNTMT1F2PRSS1PRSS2 | |
| Acetic Acid SCHEMBL3507728 | 0.90 | F2 (0.41) | F2PRSS1PRSS2PRSS3TACR1 | |
| SCHEMBL1100531 | 0.89 | PDF (0.49) | PDFNTMT1F2SSTR3TACR1 | |
| Hydrochloric Acid SCHEMBL29388894 | 0.88 | ITGB1 (0.45) | F2PRSS1PRSS2PRSS3ITGB1 | |
| SCHEMBL1498278 | 0.88 | F2 (0.42) | NTMT1F2PRSS1PRSS2PRSS3 | |
| Hydrochloric Acid SCHEMBL11528157 | 0.87 | F2 (0.42) | NTMT1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL3239444 | 0.84 | F2 (0.46) | NTMT1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL5582769 | 0.84 | NTMT1 (0.53) | PDFNTMT1F2SSTR3TACR1 | |
| SCHEMBL11417445 | 0.83 | NTMT1 (0.55) | PDFNTMT1F2SSTR3TACR1 |
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-11504414-B2 | Bacterial inhibitors | MEHARRY MEDICAL COLLEGE | 2022-11-22 | — | — | US | disclosed |
| WO-2014183168-A1 | INHIBITORY PROPEPTIDES | ORAL HEALTH AUSTRALIA PTY LTD (AU) | 2014-11-20 | — | — | WO | disclosed |