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.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 known ✓ | P22894 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.91 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12977823 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL12977820 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL12977821 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL12977814 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL12977818 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL38306 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL12977802 | 0.95 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| SCHEMBL6383674 | 0.94 | ALDH1A1 (0.85) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| Water SCHEMBL27842240 | 0.94 | ALDH1A1 (0.97) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 | |
| Methane SCHEMBL11458826 | 0.94 | ALDH1A1 (0.97) | ALDH1A1SMN1; SMN2TDP1CYP3A4L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999064487-A1 | ANIONIC AGENT FOR PAPER SURFACE SIZING | COMPAGNIA COMMERCIALE ITALIANA S.R.L. (IT) | 1999-12-16 | — | — | WO | claimed |
| WO-1999064487-A1 | ANIONIC AGENT FOR PAPER SURFACE SIZING | COMPAGNIA COMMERCIALE ITALIANA S.R.L. (IT) | 1999-12-16 | — | — | WO | disclosed |