Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.48 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CASR | P41180 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6688703 | 1.00 | PDCD1 (0.48) | PDCD1CD274SMN1; SMN2TMEM97LMNA | |
| SCHEMBL6690288 | 0.94 | SMN1; SMN2 (0.46) | PDCD1CD274SMN1; SMN2TMEM97LMNA | |
| SCHEMBL6690290 | 0.94 | SMN1; SMN2 (0.46) | PDCD1CD274SMN1; SMN2TMEM97LMNA | |
| SCHEMBL6692078 | 0.88 | NPC1 (0.55) | PDCD1CD274SMN1; SMN2LMNARAB9A | |
| SCHEMBL6692071 | 0.88 | NPC1 (0.55) | PDCD1CD274SMN1; SMN2LMNARAB9A | |
| SCHEMBL6688338 | 0.83 | MAOB (0.53) | PPARA | |
| SCHEMBL6688332 | 0.83 | MAOB (0.53) | PPARA | |
| SCHEMBL6687571 | 0.82 | MAOB (0.47) | SMN1; SMN2TMEM97LMNACASRRAB9A | |
| SCHEMBL6687574 | 0.82 | MAOB (0.47) | SMN1; SMN2TMEM97LMNACASRRAB9A | |
| SCHEMBL6685585 | 0.79 | ATM (0.49) | SMN1; SMN2TMEM97LMNACASRRAB9A |
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 |