Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.32 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.32 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | ATR | Q13535 | 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 | |
|---|---|---|---|---|
| SCHEMBL672462 | 0.82 | GSK3B (0.36) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL674120 | 0.80 | MAP4K1 (0.35) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL672347 | 0.78 | ROCK1 (0.33) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL672348 | 0.78 | ROCK1 (0.33) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL673108 | 0.74 | ROCK1 (0.36) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL673109 | 0.73 | ROCK1 (0.40) | GSK3BMAP4K1KCNH2ROCK1CDC42BPB | |
| SCHEMBL20577255 | 0.72 | HTR3A (0.41) | KCNH2ROCK1CDC42BPB | |
| SCHEMBL20577257 | 0.72 | HTR3A (0.41) | KCNH2ROCK1CDC42BPB | |
| SCHEMBL30673624 | 0.70 | HTR3A (0.38) | KCNH2ROCK1CHEK1CCNA2CDK2 | |
| SCHEMBL9901829 | 0.70 | HTR3A (0.38) | KCNH2ROCK1CHEK1CCNA2CDK2 |
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 |