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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 SCHEMBL164128 | 0.77 | — | — | |
| Acetic Acid SCHEMBL28581739 | 0.76 | CA1 (0.80) | CA1ALDH1A1CA4TDP1FFAR3 | |
| Acetic Acid SCHEMBL28283719 | 0.76 | CA1 (0.80) | CA1ALDH1A1CA4TDP1FFAR3 | |
| Acetic Acid SCHEMBL15391982 | 0.74 | CA1 (0.61) | CA1ALDH1A1CA4TDP1FFAR3 | |
| Acetic Acid SCHEMBL93968 | 0.74 | — | — | |
| Acetic Acid SCHEMBL25381310 | 0.74 | CA1 (0.61) | CA1ALDH1A1CA4TDP1FFAR3 | |
| Acetic Acid SCHEMBL7960655 | 0.74 | — | — | |
| Acetic Acid SCHEMBL8414035 | 0.74 | — | — | |
| Acetic Acid SCHEMBL22217472 | 0.74 | — | — | |
| Acetic Acid SCHEMBL23930215 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108135158-A | Improved agrochemical adjuvants | 艾特恩农业有限责任公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-107072193-A | The agricultural chemicals delivery system of amphipathic PEG poplar bundles primitive hybrid based on enzyme response or pH responses | 雷蒙特亚特特拉维夫大学有限公司 | 2017-08-18 | — | — | CN | disclosed |
| CN-102958597-B | Method for preparing microcapsules | COGNIS IP MAN GMBH | 2015-05-13 | — | — | CN | disclosed |
| CN-102958597-A | Method for preparing microcapsules | COGNIS IP MAN GMBH | 2013-03-06 | — | — | CN | disclosed |