Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. 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 | |
|---|---|---|---|---|
| Propanol SCHEMBL28927312 | 0.90 | EPHX1 (0.46) | — | |
| SCHEMBL12501988 | 0.88 | CA12 (0.50) | — | |
| SCHEMBL27121 | 0.88 | — | — | |
| Butane SCHEMBL28110601 | 0.86 | EPHX1 (0.52) | — | |
| SCHEMBL7886703 | 0.85 | — | — | |
| Ethylenediamine SCHEMBL20582708 | 0.85 | CA12 (0.47) | — | |
| Hydrochloric Acid SCHEMBL3387948 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL4717644 | 0.85 | — | — | |
| Ammonia Solution, Strong SCHEMBL16346386 | 0.85 | — | — | |
| SCHEMBL4766952 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0184408-B1 | DIAMINOALCOHOLS, THEIR PREPARATION AND THEIR USE AS ACID GAS REMOVAL AGENTS | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1988-03-23 | — | — | EP | disclosed |
| EP-0184408-A1 | Diaminoalcohols, their preparation and their use as acid gas removal agents | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1986-06-11 | — | — | EP | disclosed |