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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 12/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | ADRB1 | P08588 | 12/20 | 0.63 |
| ▸ | ADRB3 | P13945 | 12/20 | 0.63 |
| ▸ | PRKCA | P17252 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3391 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL1866116 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL1866113 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL20515564 | 0.93 | ALDH1A1 (0.68) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Benzoic Acid SCHEMBL136510 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Benzoic Acid SCHEMBL7688676 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Benzoic Acid SCHEMBL9956241 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Benzoic Acid SCHEMBL28388934 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL7144537 | 0.87 | ALDH1A1 (0.64) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Methyl Benzoate SCHEMBL29022830 | 0.86 | ADRB2 (0.59) | ALDH1A1ADRB2ADRB1ADRB3PRKCA |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115558257-A | High-toughness high-temperature-resistant novel high polymer material and preparation method and application thereof | 嘉兴高正新材料科技股份有限公司 | 2023-01-03 | — | — | CN | claimed |
| CN-115160654-A | Modified cellulose acetate fiber capable of being degraded by microorganisms and preparation method thereof | 集美大学 | 2022-10-11 | — | — | CN | claimed |
| CN-117700565-A | Recovery of component cellulose esters | 伊士曼化工公司 | 2024-03-15 | — | — | CN | disclosed |
| CN-114072429-B | Recovery of component cellulose esters | 伊士曼化工公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-115244086-A | Low hydroxyl content cellulose esters and polymeric aliphatic polyester compositions and articles | 伊士曼化工公司 | 2022-10-25 | — | — | CN | disclosed |
| CN-115160654-A | Modified cellulose acetate fiber capable of being degraded by microorganisms and preparation method thereof | 集美大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-115087369-A | Low emission cellulose ester compositions and articles made therefrom | 提克纳有限责任公司 | 2022-09-20 | — | — | CN | disclosed |
| CN-115087698-A | Cellulose ester compositions comprising other biobased polymers | 提克纳有限责任公司 | 2022-09-20 | — | — | CN | disclosed |
| CN-114981350-A | Molded articles for use with terpene-containing oils | 伊士曼化工公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-114072429-A | Recovery of constituent cellulose ester | 伊士曼化工公司 | 2022-02-18 | — | — | CN | disclosed |