Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.54 |
| ▸ | PORCN | Q9H237 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | ADH5 | P11766 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24782873 | 0.79 | LMNA (0.55) | PORCNCYP3A4CYP2D6LMNAMAPT | |
| SCHEMBL26550130 | 0.79 | PCSK9 (0.57) | PCSK9CYP3A4CYP2A6CYP2D6LMNA | |
| SCHEMBL26548539 | 0.79 | HRH4 (0.47) | CYP3A4CYP2A6CYP2D6LMNAMAPT | |
| SCHEMBL20085576 | 0.76 | CYP3A4 (0.54) | PCSK9CYP3A4CYP2A6CYP2D6LMNA | |
| SCHEMBL19296052 | 0.74 | CYP3A4 (0.59) | CYP3A4CYP2A6CYP2D6LMNAMAPT | |
| SCHEMBL13034788 | 0.73 | TSHR (0.51) | NPC1TSHRHSD17B10 | |
| SCHEMBL26548536 | 0.73 | PCSK9 (0.54) | PCSK9PORCNCYP3A4CYP2A6CYP2D6 | |
| SCHEMBL26550116 | 0.71 | CDK6 (0.46) | PCSK9CYP3A4MAPTCYP1A2CYP2C9 | |
| SCHEMBL22241708 | 0.71 | PCSK9 (1.00) | PCSK9 | |
| SCHEMBL1839540 | 0.70 | LMNA (0.61) | CYP3A4CYP2A6CYP2D6LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023196975-A1 | COMPOUNDS THAT INTERACT WITH RAS SUPERFAMILY PROTEINS FOR TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE | SHY THERAPEUTICS, LLC (US) | 2023-10-12 | — | — | WO | disclosed |