Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | F7 | P08709 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6685493 | 1.00 | ATM (0.48) | ATMCTSDNPC1PKMRAB9A | |
| SCHEMBL6687232 | 0.89 | MAOB (0.51) | CTSDNPC1PKMRAB9A | |
| SCHEMBL6687236 | 0.89 | MAOB (0.51) | CTSDNPC1PKMRAB9A | |
| SCHEMBL6685585 | 0.88 | ATM (0.49) | ATMCTSDNPC1PKMRAB9A | |
| SCHEMBL6685580 | 0.88 | ATM (0.49) | ATMCTSDNPC1PKMRAB9A | |
| SCHEMBL6687466 | 0.87 | CTSD (0.56) | CTSDNPC1PKMRAB9ACYP3A4 | |
| SCHEMBL6687470 | 0.87 | CTSD (0.56) | CTSDNPC1PKMRAB9ACYP3A4 | |
| SCHEMBL6690101 | 0.86 | ATM (0.47) | ATMCTSDNPC1PKMRAB9A | |
| SCHEMBL6690103 | 0.86 | ATM (0.47) | ATMCTSDNPC1PKMRAB9A | |
| SCHEMBL6687430 | 0.85 | ATM (0.48) | ATMCTSDNPC1PKMRAB9A |
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-2004087125-A1 | AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2004-10-14 | — | — | WO | disclosed |