Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | LATS1 | O95835 | 2/20 | 0.32 |
| ▸ | LATS2 | Q9NRM7 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL674121 | 0.82 | GSK3B (0.36) | GSK3BROCK1CDC42BPBKCNH2MAPK8 | |
| SCHEMBL672461 | 0.81 | KCNH2 (0.36) | GSK3BROCK1CDC42BPBKCNH2FLT3 | |
| SCHEMBL674039 | 0.78 | FLT3 (0.35) | GSK3BROCK1CDC42BPBKCNH2FLT3 | |
| SCHEMBL12468308 | 0.75 | GSK3B (0.33) | GSK3BROCK1CDC42BPBKCNH2FLT3 | |
| SCHEMBL672451 | 0.75 | PRKCI (0.35) | GSK3BROCK1CDC42BPBKCNH2 | |
| SCHEMBL672495 | 0.75 | GSK3B (0.38) | GSK3BKCNH2FLT3 | |
| SCHEMBL12468151 | 0.74 | KCNH2 (0.34) | GSK3BROCK1CDC42BPBKCNH2 | |
| SCHEMBL672939 | 0.73 | ROCK1 (0.30) | ROCK1CDC42BPB | |
| SCHEMBL20577257 | 0.69 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2 | |
| SCHEMBL20577255 | 0.69 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2 |
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 |