Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.57 |
| ▸ | KCNK9 | Q9NPC2 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.56 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
| ▸ | PLAU | P00749 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.51 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3661640 | 0.91 | SCN8A (0.61) | RXFP1KCNK3KCNK9MEN1KMT2A | |
| SCHEMBL13852930 | 0.90 | PARP1 (0.53) | RXFP1ALDH1A1MAPK1HSD17B10KCNK3 | |
| SCHEMBL28197272 | 0.90 | NR1H4 (0.69) | RXFP1ALDH1A1MAPK1HSD17B10KCNK3 | |
| SCHEMBL13852922 | 0.88 | KMT2A (0.62) | RXFP1ALDH1A1MAPK1HSD17B10KCNK3 | |
| SCHEMBL13852931 | 0.87 | RXFP1 (0.62) | RXFP1 | |
| SCHEMBL16266125 | 0.86 | MEN1 (0.69) | RXFP1ALDH1A1MAPK1HSD17B10KCNK3 | |
| SCHEMBL20644110 | 0.84 | SCN8A (0.65) | RXFP1KCNK3 | |
| SCHEMBL18132551 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KCNK3KCNK9MEN1KMT2A | |
| SCHEMBL30530104 | 0.80 | KMT2A (0.53) | KCNK3KCNK9MEN1KMT2A | |
| SCHEMBL20644107 | 0.80 | SCN8A (0.62) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2212290-B1 | ARYL AMIDES USEFUL AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS | VERTEX PHARMA (US) | 2014-12-03 | — | — | EP | disclosed |
| US-8779197-B2 | Aryl amides useful as inhibitors of voltage-gated sodium channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-07-15 | — | — | US | disclosed |
| WO-2009049183-A1 | ARYL AMIDES USEFUL AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-04-16 | — | — | WO | disclosed |