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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.61 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | TPMT | P51580 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29111879 | 0.84 | HCAR2 (0.60) | HCAR2MKNK1MKNK2 | |
| SCHEMBL197638 | 0.81 | — | — | |
| Acetic Acid SCHEMBL28557709 | 0.80 | HCAR2 (0.47) | HCAR2 | |
| Acetic Acid SCHEMBL27715659 | 0.80 | HCAR2 (0.48) | HCAR2MKNK1MKNK2 | |
| SCHEMBL1651203 | 0.79 | HCAR2 (0.67) | HCAR2MKNK1MKNK2 | |
| 1,3,5-Trichlorobenzene SCHEMBL28758659 | 0.78 | TPMT (0.57) | TPMT | |
| Formaldehyde SCHEMBL28060910 | 0.78 | HCAR2 (0.52) | HCAR2MKNK1MKNK2 | |
| SCHEMBL30129770 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL6069542 | 0.78 | — | — | |
| Water SCHEMBL28044737 | 0.78 | — | — |
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-101584671-B | Cefazedone sodium medicament powder injection and method for synthesizing raw medicine of Cefazedone sodium | SHANDONG LUOXIN PHARMACEUTICAL CO LTD | 2011-03-16 | — | — | CN | disclosed |
| CN-101584671-A | Cefazedone sodium medicament powder injection and method for synthesizing raw medicine of Cefazedone sodium | SHANDONG LUOXIN PHARMACEUTICAL (CN) | 2009-11-25 | — | — | CN | disclosed |