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 | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL153175 | 0.87 | TSHR (0.50) | PAOXTSHRALDH1A1CYP1A2LCK | |
| SCHEMBL151668 | 0.81 | TSHR (0.48) | TSHRALDH1A1MAPTLCKSIGMAR1 | |
| Hydrochloric Acid SCHEMBL27737564 | 0.77 | TSHR (0.50) | TSHRALDH1A1LCKSIGMAR1CHRM2 | |
| Acetic Acid SCHEMBL5571119 | 0.75 | CA12 (0.44) | PAOXTSHRALDH1A1LMNACYP1A2 | |
| Acetic Acid SCHEMBL7704581 | 0.75 | FFAR3 (0.44) | PAOXTSHRALDH1A1LMNACYP1A2 | |
| Acetic Acid SCHEMBL11511846 | 0.75 | FFAR3 (0.44) | PAOXTSHRALDH1A1LMNACYP1A2 | |
| Acetic Acid SCHEMBL27881639 | 0.74 | KDM5A (0.49) | PAOXALDH1A1LMNACYP1A2CYP2D6 | |
| SCHEMBL151280 | 0.73 | TSHR (0.57) | TSHRALDH1A1CYP1A2MAPTSMN1; SMN2 | |
| Acetic Acid SCHEMBL1244200 | 0.73 | CHRM1 (0.41) | PAOXALDH1A1CYP1A2MAPTLCK | |
| Acetic Acid SCHEMBL376170 | 0.73 | CHRM1 (0.41) | PAOXALDH1A1CYP1A2MAPTLCK |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0878554-B2 | Detection of nucleic acids by fluorescence quenching | BECTON DICKINSON CO (US) | 2017-03-22 | — | — | EP | disclosed |
| EP-0878554-B1 | Detection of nucleic acids by fluorescence quenching | BECTON DICKINSON CO (US) | 2007-02-21 | — | — | EP | disclosed |
| US-6054279-A | Detection of nucleic acids by fluorescence quenching | BECTON DICKINSON AND COMPANY (US) | 2000-04-25 | — | — | US | disclosed |
| US-5846726-A | Detection of nucleic acids by fluorescence quenching | BECTON, DICKINSON AND COMPANY (US) | 1998-12-08 | — | — | US | disclosed |
| EP-0878554-A2 | Detection of nucleic acids by fluorescence quenching | Becton, Dickinson and Company (US) | 1998-11-18 | — | — | EP | disclosed |