Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetaldehyde. 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 | |
|---|---|---|---|---|
| Acetaldehyde SCHEMBL4296687 | 0.96 | — | — | |
| Acetaldehyde SCHEMBL3400941 | 0.96 | — | — | |
| Acetaldehyde SCHEMBL662140 | 0.96 | — | — | |
| Acetaldehyde SCHEMBL20959767 | 0.96 | — | — | |
| Acetaldehyde SCHEMBL28444033 | 0.92 | — | — | |
| Acetaldehyde SCHEMBL28142446 | 0.88 | — | — | |
| Acetaldehyde SCHEMBL9218119 | 0.88 | — | — | |
| Propanol SCHEMBL27720977 | 0.85 | ALDH1A1 (0.43) | — | |
| Acetaldehyde SCHEMBL9338605 | 0.85 | — | — | |
| Acetic Acid SCHEMBL10531259 | 0.82 | FFAR3 (0.47) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090082605-A1 | From a feedstock comprising ethanol; non-petroleum routes; via the dehydration of ethanol; route to ethanol from synthesis gas made via hydrocarbon such as natural gas | BP CHEMICALS LIMITED | 2009-03-26 | — | — | US | disclosed |