Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | GCGR | P47871 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| P-Xylene SCHEMBL3200566 | 0.97 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| P-Xylene SCHEMBL11202857 | 0.92 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| P-Cresol SCHEMBL168366 | 0.88 | ACHE (0.59) | ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1 | |
| Toluene SCHEMBL10674880 | 0.88 | LMNA (0.50) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Cetyl Alcohol SCHEMBL28089261 | 0.87 | LMNA (0.65) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Octanol SCHEMBL8391778 | 0.87 | LMNA (0.65) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL28379306 | 0.86 | ACHE (0.56) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Toluene SCHEMBL1158310 | 0.85 | LMNA (0.52) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Toluene SCHEMBL11558249 | 0.85 | LMNA (0.52) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Toluene SCHEMBL10337305 | 0.83 | LMNA (0.50) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4788277-A | OXIDATIVE COUPLING, CATALYST CONTAINING COPPER, DIAMINE, HALOGEN | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1988-11-29 | — | — | US | disclosed |