Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL672939 | 0.87 | ROCK1 (0.30) | ROCK1CDC42BPB | |
| SCHEMBL672461 | 0.75 | KCNH2 (0.36) | PRKCIROCK1CDC42BPBGSK3BKCNH2 | |
| SCHEMBL672462 | 0.75 | GSK3B (0.36) | ROCK1CDC42BPBGSK3BKCNH2 | |
| SCHEMBL12468151 | 0.72 | KCNH2 (0.34) | ROCK1CDC42BPBIKBKBGSK3BKCNH2 | |
| SCHEMBL672348 | 0.69 | ROCK1 (0.33) | ROCK1CDC42BPBGSK3BKCNH2 | |
| SCHEMBL672347 | 0.69 | ROCK1 (0.33) | ROCK1CDC42BPBGSK3BKCNH2 | |
| SCHEMBL674039 | 0.66 | FLT3 (0.35) | PRKCIROCK1CDC42BPBGSK3BKCNH2 | |
| SCHEMBL20577257 | 0.66 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2 | |
| SCHEMBL20577255 | 0.66 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2 | |
| SCHEMBL673109 | 0.65 | ROCK1 (0.40) | ROCK1CDC42BPBGSK3BKCNH2 |
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-2012022045-A1 | PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2012-02-23 | — | — | WO | disclosed |