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 | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | SI | P14410 | 2/20 | 0.52 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL10936107 | 0.95 | FFAR3 (0.53) | MGAMGAASIMGAM2TSHR | |
| Bicarbonate SCHEMBL2679176 | 0.91 | TSHR (0.53) | MGAMGAASIMGAM2TSHR | |
| Acetone SCHEMBL28995064 | 0.91 | MGAM (0.55) | MGAMGAASIMGAM2TSHR | |
| SCHEMBL27583315 | 0.91 | TSHR (0.59) | MGAMGAASIMGAM2TSHR | |
| SCHEMBL15434 | 0.91 | — | — | |
| SCHEMBL3288569 | 0.91 | — | — | |
| Benzene SCHEMBL27929884 | 0.88 | TSHR (0.50) | MGAMGAASIMGAM2TSHR | |
| Propionic Acid SCHEMBL134040 | 0.88 | FFAR3 (0.59) | MGAMGAASIMGAM2TSHR | |
| SCHEMBL4652748 | 0.88 | — | — | |
| SCHEMBL4653893 | 0.88 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117013067-A | Mixed lithium-storage lithium ion battery electrolyte and preparation and application thereof | 上海交通大学 | 2023-11-07 | — | — | CN | disclosed |
| CN-116920819-A | High-stability catalyst for synthesizing methyl acrylate or methyl methacrylate and preparation method and application thereof | 郑州大学 | 2023-10-24 | — | — | CN | disclosed |
| CN-112521281-B | Synthesis method of methyl acrylate | 中国石油化工股份有限公司 | 2023-07-04 | — | — | CN | disclosed |
| CN-112705188-B | Method for synthesizing methyl acrylate | 中国石油化工股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-112707814-A | Method for preparing methyl acrylate from methyl acetate | 中国石油化工股份有限公司 | 2021-04-27 | — | — | CN | disclosed |
| CN-112705188-A | Method for synthesizing methyl acrylate | 中国石油化工股份有限公司 | 2021-04-27 | — | — | CN | disclosed |
| CN-112521281-A | Method for synthesizing methyl acrylate | 中国石油化工股份有限公司 | 2021-03-19 | — | — | CN | disclosed |
| CN-110639492-A | Catalyst for preparing methyl acrylate from methyl acetate and formaldehyde and application thereof | 中国石油化工股份有限公司 | 2020-01-03 | — | — | CN | disclosed |
| EP-2450997-B1 | Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same | MITSUBISHI CHEM CORP (JP) | 2017-03-22 | — | — | EP | disclosed |
| CN-1323289-A | Aminoalcohol derivatives and their use as beta3Use of adrenergic agonists | FUJISAWA PHARMACEUTICAL CO (JP) | 2001-11-21 | — | — | CN | disclosed |
| US-5565476-A | RENIN INHIBITORS FOR TREATMENT OF CONGESTIVE HEART FAILURE AND HYPERTENSION | BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) | 1996-10-15 | — | — | US | disclosed |
| US-5554634-A | HYPOTENSIVE | BIO-MEGA BOEHRINGER INGELHEIM RESEARCH INC. (CA) | 1996-09-10 | — | — | US | disclosed |
| US-5246618-A | Vapor degreasing for removal of solder fluxes | KALI-CHEMIE AG (DE) | 1993-09-21 | — | — | US | disclosed |
| US-5114609-A | Chlorofluorohydrocarbon, alkanol, and ethyl or methyl propionate or ethyl acetate; printed circuits | KALI-CHEMIE AG (DE) | 1992-05-19 | — | — | US | disclosed |