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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 8/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
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 SCHEMBL28757036 | 1.00 | KDM4E (0.48) | KDM4ETBXAS1KMT2ACYP17A1TBXA2R | |
| Bicarbonate SCHEMBL28519256 | 0.95 | KDM4E (0.49) | KDM4ETBXAS1KMT2ACYP17A1TBXA2R | |
| Bicarbonate SCHEMBL28515282 | 0.94 | KDM4E (0.50) | KDM4ETBXAS1KMT2ACYP17A1TBXA2R | |
| SCHEMBL16163925 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL10456414 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL5090773 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL28401023 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL16163817 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL5086764 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 | |
| SCHEMBL5084037 | 0.91 | TBXAS1 (0.49) | KDM4ETBXAS1KMT2ACYP17A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118290346-A | Method for producing amide compound, and amide compound | 广荣化学株式会社 | 2024-07-05 | — | — | CN | disclosed |
| CN-112703184-B | Method for producing amide compound, and amide compound | 广荣化学株式会社 | 2024-06-11 | — | — | CN | disclosed |