Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.68 |
| ▸ | RAB9A | P51151 | 6/20 | 0.68 |
| ▸ | JAK2 | O60674 | 1/20 | 0.68 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.65 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.65 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.65 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.65 |
| ▸ | CLK2 | P49760 | 2/20 | 0.65 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.65 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.65 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.65 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.65 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.65 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.65 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.65 |
| ▸ | MAOB | P27338 | 3/20 | 0.62 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.61 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.61 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL2382404 | 0.93 | NPC1 (0.60) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL27576006 | 0.86 | MAOB (0.64) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL5415117 | 0.84 | MAOB (0.80) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL3380296 | 0.81 | NPC1 (1.00) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL15764655 | 0.79 | NPC1 (0.76) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL15764694 | 0.79 | NPC1 (0.76) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL1664461 | 0.79 | NPC1 (1.00) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL2380299 | 0.79 | ABL1 (0.52) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL2566770 | 0.77 | NPC1 (0.65) | NPC1RAB9AJAK2ROCK2ROCK1 | |
| SCHEMBL5381378 | 0.77 | NPC1 (0.76) | NPC1RAB9AJAK2ROCK2ROCK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |