Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | PPID | Q08752 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL34467582 | 0.85 | CYP2C9 (0.42) | NPC1RAB9AALDH1A1CYP2C19LMNA | |
| SCHEMBL3463439 | 0.78 | L3MBTL1 (0.44) | ALDH1A1CYP2C19CYP2D6MAPTRIPK1 | |
| SCHEMBL20009173 | 0.74 | ALDH1A1 (0.53) | NPC1RAB9AALDH1A1LMNAGAA | |
| SCHEMBL3224087 | 0.73 | PPID (0.56) | ALDH1A1LMNASMN1; SMN2MAPTPPID | |
| SCHEMBL28034055 | 0.73 | LMNA (0.49) | NPC1RAB9AALDH1A1CYP2C19LMNA | |
| SCHEMBL9827781 | 0.72 | SMN1; SMN2 (0.43) | ALDH1A1CYP2C19LMNACYP2D6SMN1; SMN2 | |
| SCHEMBL1557963 | 0.71 | ALDH1A1 (0.44) | RAB9AALDH1A1CYP2C19LMNACYP2D6 | |
| SCHEMBL31019585 | 0.71 | SMN1; SMN2 (0.40) | ALDH1A1CYP2C19LMNACYP2D6SMN1; SMN2 | |
| SCHEMBL4556797 | 0.70 | RIPK1 (0.42) | NPC1RAB9ACYP2C19LMNACYP2D6 | |
| SCHEMBL4207496 | 0.70 | TSHR (0.51) | NPC1RAB9AALDH1A1CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4200652-A | ADRENERGIC BLOCKING AGENTS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1980-04-29 | — | — | US | disclosed |
| US-4115409-A | CARDIOVASCULAR DISORDERS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1978-09-19 | — | — | US | disclosed |