Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 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 |
| ▸ | GSK3B | P49841 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL672347 | 0.90 | ROCK1 (0.33) | ROCK1CDC42BPBMAP4K1MAP4K3BMPR1B | |
| SCHEMBL673109 | 0.81 | ROCK1 (0.40) | ROCK1CDC42BPBMAP4K1GSK3BKCNH2 | |
| SCHEMBL674121 | 0.78 | GSK3B (0.36) | ROCK1CDC42BPBMAP4K1MAP4K3BMPR1B | |
| SCHEMBL674120 | 0.78 | MAP4K1 (0.35) | ROCK1CDC42BPBMAP4K1MAP4K3GSK3B | |
| SCHEMBL673108 | 0.77 | ROCK1 (0.36) | ROCK1CDC42BPBMAP4K1GSK3BKCNH2 | |
| SCHEMBL4367345 | 0.72 | ROCK1 (0.39) | ROCK1KCNH2MKNK1MKNK2HTR3A | |
| SCHEMBL4367350 | 0.72 | ROCK1 (0.39) | ROCK1KCNH2MKNK1MKNK2HTR3A | |
| SCHEMBL20577257 | 0.72 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2MKNK1MKNK2 | |
| SCHEMBL20577255 | 0.72 | HTR3A (0.41) | ROCK1CDC42BPBKCNH2MKNK1MKNK2 | |
| SCHEMBL672451 | 0.69 | PRKCI (0.35) | 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 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 |