Known targets — ChEMBL curated mechanism
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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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL45038 | 0.94 | NOTUM (0.41) | NOTUMPPARARAB9ASMN1; SMN2NPC1 | |
| SCHEMBL44282 | 0.88 | PPARA (0.41) | PPARARAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL44365 | 0.88 | NOTUM (0.50) | NOTUMPPARARAB9ASMN1; SMN2NPC1 | |
| SCHEMBL44654 | 0.84 | RAB9A (0.37) | NOTUMPPARARAB9ASMN1; SMN2NPC1 | |
| SCHEMBL44223 | 0.84 | RAB9A (0.37) | NOTUMPPARARAB9ASMN1; SMN2NPC1 | |
| SCHEMBL44040 | 0.83 | SMN1; SMN2 (0.39) | PPARARAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL44515 | 0.83 | MAPT (0.39) | PPARARAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL45433 | 0.83 | GLA (0.37) | RAB9ANPC1KMT2AALDH1A1PTPN1 | |
| SCHEMBL44269 | 0.83 | RAB9A (0.42) | PPARARAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL44465 | 0.83 | MAPK1 (0.45) | RAB9ASMN1; SMN2NPC1L3MBTL1TDP1 |
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-2011137587-A1 | CYTOKINE INHIBITORS | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-11-10 | — | — | WO | claimed |
| WO-2011137587-A1 | CYTOKINE INHIBITORS | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-11-10 | — | — | WO | disclosed |