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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320549 | 0.90 | TSHR (0.61) | TSHRLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL31480060 | 0.90 | TSHR (0.61) | TSHRLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL1848576 | 0.90 | TSHR (0.61) | TSHRLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL3632972 | 0.90 | TSHR (0.61) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Butyl Alcohol SCHEMBL7798119 | 0.88 | ALDH1A1 (0.63) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8735592 | 0.87 | TSHR (0.57) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6563761 | 0.87 | TSHR (0.57) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Fluoride SCHEMBL11696786 | 0.87 | TSHR (0.57) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL150721 | 0.87 | TSHR (0.57) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11652942 | 0.87 | TSHR (0.57) | TSHRLMNAALDH1A1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808849-B1 | Process for the production of ethylenic polymers | SHOWA DENKO KK (JP) | 2001-12-19 | — | — | EP | disclosed |
| US-6011127-A | CATALYST COMPRISING A CHROMIUM COMPOUND, AN ALUMOXANE AND AN ORGANOMETALLIC ALKOXIDE AND/OR ORGANOMETALLIC SILOXIDE AND A CARRIER SUPPORTING THEREON THESE COMPOUNDS. | SHOWA DENKO K.K. (JP) | 2000-01-04 | — | — | US | disclosed |
| EP-0808849-A1 | Process for the production of ethylenic polymers | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1997-11-26 | — | — | EP | disclosed |