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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.34 |
| ▸ | SCN5A known ✓ | Q14524 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 SCHEMBL18812928 | 0.98 | ALDH1A1 (0.52) | ALDH1A1TSHRTHRBCA2HPGD | |
| Bicarbonate SCHEMBL3389077 | 0.93 | TSHR (0.50) | ALDH1A1TSHRTHRBCA2HPGD | |
| Acetic Acid SCHEMBL5086365 | 0.90 | ALDH1A1 (0.64) | ALDH1A1TSHRTHRBHPGDNPC1 | |
| Acetic Acid SCHEMBL5166708 | 0.90 | ALDH1A1 (0.42) | ALDH1A1TSHRTHRBCA2LMNA | |
| Acetic Acid SCHEMBL11973815 | 0.90 | ALDH1A1 (0.64) | ALDH1A1TSHRTHRBHPGDNPC1 | |
| Acetic Acid SCHEMBL950771 | 0.90 | ALDH1A1 (0.64) | ALDH1A1TSHRTHRBHPGDNPC1 | |
| Acetic Acid SCHEMBL775971 | 0.90 | ALDH1A1 (0.42) | ALDH1A1TSHRTHRBCA2LMNA | |
| Ether SCHEMBL4871563 | 0.87 | ALDH1A1 (0.61) | ALDH1A1TSHRTHRBHPGDNPC1 | |
| Acetic Acid SCHEMBL1356765 | 0.87 | ALDH1A1 (0.61) | ALDH1A1TSHRTHRBHPGDNPC1 | |
| Acetic Acid SCHEMBL8395404 | 0.87 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRBCA2LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116709723-A | Radiating plate, method of manufacturing the same, and image display apparatus including the same | 东友精细化工有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-107203096-B | Negative photosensitive resin composition and photocured pattern made therefrom | 东友精细化工有限公司 | 2020-07-10 | — | — | CN | disclosed |
| CN-111334157-A | Powder coating for wooden furniture and preparation method thereof | 安徽华辉塑业科技股份有限公司 | 2020-06-26 | — | — | CN | disclosed |
| CN-104194423-A | Fireproof coating for wooden furniture and preparation method thereof | SUZHOU SHENGPULA NEW MATERIAL TECHNOLOGY CO LTD | 2014-12-10 | — | — | CN | disclosed |
| US-20090026425-A1 | COMPOSITION COMPRISING POLYESTER AMIDE ACID AND THE LIKE AND INK-JET INK COMPOSITION USING THE SAME | CHISSO CORPORATION (JP) | 2009-01-29 | — | — | US | disclosed |