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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 18/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 SCHEMBL30717264 | 1.00 | NT5E (0.39) | NT5ELMNATHRBSMN1; SMN2HIF1A | |
| SCHEMBL30008384 | 0.84 | NT5E (0.44) | NT5ELMNAALDH1A1TP53MAPT | |
| SCHEMBL30812574 | 0.83 | LMNA (0.48) | NT5ELMNATHRBSMN1; SMN2HIF1A | |
| SCHEMBL27210203 | 0.83 | LMNA (0.48) | NT5ELMNATHRBSMN1; SMN2HIF1A | |
| SCHEMBL30008321 | 0.82 | NT5E (0.45) | NT5E | |
| SCHEMBL30007802 | 0.80 | NT5E (0.47) | NT5E | |
| Acetic Acid SCHEMBL30812570 | 0.80 | LMNA (0.43) | NT5ELMNATHRBSMN1; SMN2HIF1A | |
| SCHEMBL27210201 | 0.79 | NT5E (0.39) | NT5E | |
| SCHEMBL27210197 | 0.75 | NT5E (0.37) | NT5ELMNATHRBSMN1; SMN2HIF1A | |
| SCHEMBL27210204 | 0.73 | NT5E (0.57) | NT5E |
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-117466964-B | Nucleoside diphosphate compound and preparation method thereof | 南京烁慧医药科技有限公司 | 2026-05-15 | — | — | CN | disclosed |
| CN-117466964-A | Nucleoside diphosphate compound and preparation method thereof | 南京烁慧医药科技有限公司 | 2024-01-30 | — | — | CN | disclosed |