Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.31 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL672461 | 0.79 | KCNH2 (0.36) | KCNH2ADORA2BGSK3BROCK1CDC42BPB | |
| SCHEMBL672462 | 0.74 | GSK3B (0.36) | KCNH2GSK3BROCK1CDC42BPB | |
| SCHEMBL672451 | 0.72 | PRKCI (0.35) | KCNH2GSK3BROCK1CDC42BPBIKBKB | |
| SCHEMBL674039 | 0.72 | FLT3 (0.35) | KCNH2ADORA2BGSK3BROCK1CDC42BPB | |
| SCHEMBL12468308 | 0.71 | GSK3B (0.33) | KCNH2ADORA2BGSK3BROCK1CDC42BPB | |
| SCHEMBL672495 | 0.70 | GSK3B (0.38) | KCNH2MAPK11MAPK14GSK3B | |
| SCHEMBL672939 | 0.70 | ROCK1 (0.30) | ROCK1CDC42BPB | |
| SCHEMBL674120 | 0.68 | MAP4K1 (0.35) | KCNH2ADORA2BGSK3BROCK1CDC42BPB | |
| SCHEMBL20577257 | 0.67 | HTR3A (0.41) | KCNH2ROCK1CDC42BPBHTR3A | |
| SCHEMBL20577255 | 0.67 | HTR3A (0.41) | KCNH2ROCK1CDC42BPBHTR3A |
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-2606051-A1 | PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF | Hutchison Medipharma Limited (CN) | 2013-06-26 | — | — | EP | disclosed |
| WO-2012022045-A1 | PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2012-02-23 | — | — | WO | disclosed |
| WO-2012022265-A1 | PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2012-02-23 | — | — | WO | disclosed |