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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 known ✓ | P41145 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 8/20 | 0.53 |
| ▸ | TMPRSS11D | O60235 | 12/20 | 0.46 |
| ▸ | F10 | P00742 | 4/20 | 0.44 |
| ▸ | PLG | P00747 | 3/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | TMPRSS6 | Q8IU80 | 1/20 | 0.41 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.41 |
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 SCHEMBL8378098 | 0.94 | F2 (0.53) | F2TMPRSS11DF10PLGOPRM1 | |
| Acetic Acid SCHEMBL8378102 | 0.94 | F2 (0.53) | F2TMPRSS11DF10PLGOPRM1 | |
| Hydrochloric Acid SCHEMBL8381908 | 0.88 | F2 (0.56) | F2OPRM1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL6477266 | 0.80 | F2 (0.53) | F2F10OPRM1OPRD1OPRK1 | |
| Acetic Acid SCHEMBL6484482 | 0.79 | F2 (0.57) | F2F10ALDH1A1 | |
| SCHEMBL6475503 | 0.78 | F2 (0.50) | F2TMPRSS11DF10ALDH1A1 | |
| SCHEMBL9231271 | 0.77 | F2 (0.61) | F2TMPRSS11DF10PLG | |
| SCHEMBL6477356 | 0.76 | F2 (0.51) | F2TMPRSS11DF10ALDH1A1 | |
| SCHEMBL6477281 | 0.75 | F2 (0.51) | F2F10ALDH1A1 | |
| SCHEMBL9235632 | 0.75 | F2 (0.60) | F2TMPRSS11DF10PLG |
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-5932567-A | Thrombin inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 1999-08-03 | — | — | US | disclosed |