Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | FDPS | P14324 | 7/20 | 0.32 |
| ▸ | GGPS1 | O95749 | 4/20 | 0.32 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL5963005 | 0.89 | — | — | |
| Tert-Butanol SCHEMBL27721001 | 0.87 | TSHR (0.35) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL27741846 | 0.87 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL27720982 | 0.87 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL27256510 | 0.87 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Tert-Butanol SCHEMBL2516745 | 0.87 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Tert-Butanol SCHEMBL5623893 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Tert-Butanol SCHEMBL20985481 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Tert-Butanol SCHEMBL27720983 | 0.81 | ALDH1A1 (0.40) | ALDH1A1TSHR | |
| Tridecan-1-Ol SCHEMBL5174044 | 0.79 | TSHR (0.72) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101291901-A | Polyvinyl ether compound | IDEMITSU KOSAN CO (JP) | 2008-10-22 | — | — | CN | disclosed |