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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
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 SCHEMBL9166776 | 1.00 | THRB (0.41) | THRBCYP2C9EPHX2TSHREPHX1 | |
| Methacrylic Acid SCHEMBL12802644 | 0.88 | EPHX2 (0.38) | THRBCYP2C9EPHX2TSHREPHX1 | |
| SCHEMBL453075 | 0.83 | GRIN1 (0.45) | THRBCYP2C9EPHX2TSHR | |
| SCHEMBL3361 | 0.83 | GRIN1 (0.45) | THRBCYP2C9EPHX2TSHR | |
| Chloroacetic Acid SCHEMBL31264078 | 0.81 | TSHR (0.43) | THRBCYP2C9EPHX2TSHRALDH1A1 | |
| Acrylic Acid SCHEMBL2421359 | 0.81 | THRB (0.45) | THRBCYP2C9EPHX2TSHREPHX1 | |
| Bromoacetic Acid SCHEMBL1628769 | 0.81 | TSHR (0.43) | THRBCYP2C9EPHX2TSHREPHX1 | |
| Phosphine SCHEMBL25178082 | 0.80 | GRIN1 (0.43) | THRBCYP2C9EPHX2TSHR | |
| Hydrochloric Acid SCHEMBL11259068 | 0.80 | LMNA (0.47) | THRBCYP2C9EPHX2TSHR | |
| Ammonia Solution, Strong SCHEMBL6964589 | 0.80 | GRIN1 (0.43) | THRBCYP2C9EPHX2TSHR |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0660935-A1 | IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS | GEC-MARCONI LIMITED (GB) | 1995-07-05 | — | — | EP | claimed |
| EP-0653065-A1 | SEPARATION METHOD | GEC-MARCONI LIMITED (GB) | 1995-05-17 | — | — | EP | claimed |
| WO-1994003807-A1 | SEPARATION METHOD | GEC-MARCONI LIMITED (GB) | 1994-02-17 | — | — | WO | claimed |
| WO-1994003811-A1 | IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS | GEC-MARCONI LIMITED (GB) | 1994-02-17 | — | — | WO | claimed |
| US-20120318969-A1 | METHOD FOR THE DIFFERENTIATION OF ALTERNATIVE SOURCES OF NAPHTHENIC ACIDS | UNIVERSITY OF PLYMOUTH (GB) | 2012-12-20 | — | — | US | disclosed |
| CN-1114961-A | Peptide inhibitors of cell adhesion | TANABE SEIYAKU CO (JP) | 1996-01-17 | — | — | CN | disclosed |
| EP-0660935-A1 | IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS | GEC-MARCONI LIMITED (GB) | 1995-07-05 | — | — | EP | disclosed |
| EP-0653065-A1 | SEPARATION METHOD | GEC-MARCONI LIMITED (GB) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994012878-A1 | SEPARATION METHOD | GEC-MARCONI LIMITED (GB) | 1994-06-09 | — | — | WO | disclosed |
| WO-1994003811-A1 | IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS | GEC-MARCONI LIMITED (GB) | 1994-02-17 | — | — | WO | disclosed |
| WO-1994003807-A1 | SEPARATION METHOD | GEC-MARCONI LIMITED (GB) | 1994-02-17 | — | — | WO | disclosed |