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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 SCHEMBL1244200 | 0.97 | CHRM1 (0.41) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL376170 | 0.97 | CHRM1 (0.41) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL27616258 | 0.95 | CHRM2 (0.40) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Bicarbonate SCHEMBL7562410 | 0.90 | CHRM2 (0.38) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetone SCHEMBL6764043 | 0.90 | CHRM1 (0.43) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL9168720 | 0.87 | FFAR3 (0.41) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL303387 | 0.87 | FFAR3 (0.47) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL27743181 | 0.87 | FFAR3 (0.47) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL3408851 | 0.87 | FFAR3 (0.47) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| Acetic Acid SCHEMBL599872 | 0.87 | FFAR3 (0.47) | CHRM2CHRM4CHRM5CHRM1CHRM3 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108872441-A | A method of measurement Glucosamine and chondroitin sulfate | 江苏康缘药业股份有限公司 | 2018-11-23 | — | — | CN | claimed |
| CN-101285803-B | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRUG CONTROL | 2011-06-08 | — | — | CN | claimed |
| CN-101285803-A | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRU (CN) | 2008-10-15 | — | — | CN | claimed |
| CN-108872441-B | Method for measuring glucosamine and chondroitin sulfate | 江苏康缘药业股份有限公司 | 2021-09-03 | — | — | CN | disclosed |
| CN-108872441-A | A method of measurement Glucosamine and chondroitin sulfate | 江苏康缘药业股份有限公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-106124677-B | Method for establishing fritillaria ussuriensis medicinal material fingerprint spectrum | 广西梧州制药（集团）股份有限公司 | 2018-01-16 | — | — | CN | disclosed |
| CN-106124677-A | Method for establishing fritillaria ussuriensis medicinal material fingerprint spectrum | 广西梧州制药（集团）股份有限公司 | 2016-11-16 | — | — | CN | disclosed |
| CN-101285803-B | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRUG CONTROL | 2011-06-08 | — | — | CN | disclosed |
| CN-101285803-B | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRUG CONTROL | 2011-06-08 | — | — | CN | disclosed |
| CN-101285803-A | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRU (CN) | 2008-10-15 | — | — | CN | disclosed |
| CN-101285803-A | Qualitative analysis detection method for low polarity sugar-reducing chemical medicament in traditional Chinese medicine | BEIJING DONGCHENG INST FOR DRU (CN) | 2008-10-15 | — | — | CN | disclosed |