Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | IL1B | P01584 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1594026 | 0.92 | NPC1 (0.44) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL177934 | 0.85 | NPC1 (0.46) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL177759 | 0.85 | NPC1 (0.46) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL1595273 | 0.82 | EPHX2 (0.49) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL1594530 | 0.82 | EPHX2 (0.49) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL12704324 | 0.81 | EPHX2 (0.47) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL13127147 | 0.80 | EPHX2 (0.41) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL1595586 | 0.79 | EPHX2 (0.44) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL177908 | 0.79 | EPHX2 (0.44) | NPC1RAB9AL3MBTL1EPHX2P2RX7 | |
| SCHEMBL177987 | 0.78 | EPHX2 (0.46) | NPC1RAB9AL3MBTL1EPHX2P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2243772-A1 | Novel P2X7R antagonists and their use | Affectis Pharmaceuticals AG (DE) | 2010-10-27 | — | — | EP | disclosed |