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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA4 | P22748 | 3/20 | 0.46 |
| ▸ | CA7 | P43166 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HMGB1 | P09429 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL27864731 | 0.94 | FOLH1 (0.55) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL602386 | 0.94 | FOLH1 (0.59) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL27690026 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| Hydrochloric Acid SCHEMBL3624217 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| Hydrogen Sulfide SCHEMBL27518474 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| Water SCHEMBL28844415 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL28805448 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL27495555 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL27345540 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT | |
| SCHEMBL27334154 | 0.92 | FOLH1 (0.57) | FOLH1ALDH1A1ALOX15TSHRHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102023220-A | Methods of diagnosing cervical cancer | ARBOR VITA CORP | 2011-04-20 | — | — | CN | disclosed |
| CN-1695058-B | method for diagnosing cervical cancer | ARBOR VITA CORP | 2011-04-13 | — | — | CN | disclosed |
| CN-1695058-A | method for diagnosing cervical cancer | ARBOR VITA CORP (US) | 2005-11-09 | — | — | CN | disclosed |