Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid Methyl Ester. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 Methyl Ester SCHEMBL2700263 | 0.97 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28118680 | 0.93 | ALDH1A1 (0.67) | — | |
| Acetic Acid Methyl Ester SCHEMBL8854353 | 0.93 | ALDH1A1 (0.67) | — | |
| Acetic Acid Methyl Ester SCHEMBL1578697 | 0.93 | ALDH1A1 (0.67) | — | |
| Acetic Acid Methyl Ester SCHEMBL28852227 | 0.90 | ALDH1A1 (0.62) | — | |
| Benzene SCHEMBL27944069 | 0.89 | ALDH1A1 (0.53) | — | |
| Acetic Acid Methyl Ester SCHEMBL28319545 | 0.89 | ALDH1A1 (0.53) | — | |
| Acetic Acid Methyl Ester SCHEMBL27511456 | 0.86 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL7121041 | 0.86 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL7122055 | 0.86 | ALDH1A1 (0.91) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101921276-B | Crystallization refining method of Meropenem | JIANGSU TIANHE DESANO PHARMACEUTICAL CO LTD | 2012-07-18 | — | — | CN | disclosed |
| CN-101921276-A | Crystallization refining method of Meropenem | JIANGSU TIANHE DESANO PHARMACEUTICAL CO LTD | 2010-12-22 | — | — | CN | disclosed |