Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 5/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.52 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.51 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.51 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.51 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
| ▸ | PPARD | Q03181 | 2/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22871422 | 0.88 | MAPT (0.48) | PYGLRAB9ACYP1A2CYP2C19KCNK2 | |
| SCHEMBL7341170 | 0.85 | PYGL (0.58) | PYGLPDK1PDK2PDK3PDK4 | |
| SCHEMBL8317775 | 0.83 | LMNA (0.47) | PYGLALOX15PDK1PDK2PDK3 | |
| SCHEMBL27284321 | 0.82 | KDM4E (0.55) | ALOX15RAB9ACYP1A2CYP2C19TP53 | |
| SCHEMBL16148162 | 0.81 | PYGL (0.62) | PYGLALOX15PDK1PDK2PDK3 | |
| SCHEMBL7340569 | 0.80 | PYGL (0.61) | PYGLALOX15PDK1PDK2PDK3 | |
| SCHEMBL16147803 | 0.80 | PYGL (0.52) | PYGLPDK1PDK2PDK3PDK4 | |
| SCHEMBL31586268 | 0.78 | KCNK2 (0.50) | PYGLRAB9ACYP1A2CYP2C19KCNK2 | |
| SCHEMBL22871312 | 0.78 | KCNK2 (0.50) | PYGLRAB9ACYP1A2CYP2C19KCNK2 | |
| SCHEMBL1160893 | 0.76 | AURKA (0.48) | ALOX15MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0636625-B1 | Tricyclic diazepines vasopressin and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1999-01-27 | — | — | EP | disclosed |