Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
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 SCHEMBL7775757 | 0.99 | CYP2D6 (0.44) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL4765531 | 0.89 | SMN1; SMN2 (0.43) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL4768599 | 0.88 | SMN1; SMN2 (0.43) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL4764091 | 0.83 | ROCK2 (0.42) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL4768662 | 0.82 | SMN1; SMN2 (0.43) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL4774916 | 0.82 | ROCK2 (0.41) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL4768667 | 0.82 | SMN1; SMN2 (0.44) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL4770440 | 0.82 | SMN1; SMN2 (0.43) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| SCHEMBL7775538 | 0.81 | ROCK2 (0.41) | CYP2D6CNR1CNR2SMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL4764481 | 0.81 | SMN1; SMN2 (0.42) | CYP2D6CNR1CNR2SMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1123702-A1 | ANALGESICS | Eisai Co., Ltd. (JP) | 2001-08-16 | — | — | EP | claimed |
| EP-1123702-A1 | ANALGESICS | Eisai Co., Ltd. (JP) | 2001-08-16 | — | — | EP | disclosed |