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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.33 |
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 SCHEMBL14322291 | 0.82 | APAF1 (0.39) | MTNR1AMTNR1BAPAF1KMT2A | |
| SCHEMBL1334903 | 0.80 | MIF (0.41) | MTORRAB9AGRM7 | |
| Acetic Acid SCHEMBL8076703 | 0.72 | MIF (0.39) | MTNR1AMTNR1BAPAF1KMT2A | |
| Benzene SCHEMBL27541533 | 0.70 | CA12 (0.53) | ALDH1A1KMT2AMTOR | |
| Isopropylbenzene SCHEMBL28209871 | 0.69 | TAAR1 (0.45) | ALDH1A1RAB9A | |
| SCHEMBL28568357 | 0.69 | MTOR (0.69) | ALDH1A1MTORRAB9AGRM7 | |
| Acetic Acid SCHEMBL27701246 | 0.68 | ALDH1A1 (0.48) | ALDH1A1 | |
| Acetic Acid SCHEMBL14343057 | 0.68 | KMT2A (0.59) | ALDH1A1KMT2A | |
| Acetic Acid SCHEMBL27951213 | 0.68 | MTNR1A (0.45) | MTNR1AMTNR1BAPAF1MTORRAB9A | |
| Acetic Acid SCHEMBL29170764 | 0.68 | KMT2A (0.59) | ALDH1A1KMT2A |
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-117883585-A | Medicine for targeting fibroblast activation protein and application thereof | 无锡诺宇医药科技有限公司 | 2024-04-16 | — | — | CN | disclosed |
| CN-117186087-A | Carbonic anhydrase IX targeted radioactive diagnosis and treatment medicine and preparation method thereof | 无锡诺宇医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |