Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 7/20 | 0.65 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.65 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.65 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL19063311 | 1.00 | GABRA1 (0.65) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696779 | 0.90 | GABRA1 (0.65) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL21238213 | 0.90 | GABRA1 (0.65) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696702 | 0.89 | GABRA1 (0.70) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22756033 | 0.89 | GABRA1 (0.70) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL15125291 | 0.87 | MAPK1 (0.67) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696782 | 0.84 | GABRA1 (0.67) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22756100 | 0.84 | GABRA1 (0.67) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22756042 | 0.84 | MAPK1 (0.72) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696701 | 0.84 | MAPK1 (0.72) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 |
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-3184512-B1 | ANESTHETIC COMPOUNDS AND RELATED METHODS OF USE | MASSACHUSETTS GEN HOSPITAL (US) | 2020-12-23 | — | — | EP | disclosed |