Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 12/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | LYN | P07948 | 1/20 | 0.39 |
| ▸ | GRK2 | P25098 | 1/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14600758 | 0.82 | GSK3B (0.41) | GSK3BKCNH2CHRM1LYNGRK2 | |
| SCHEMBL14286128 | 0.79 | CCNC (0.41) | — | |
| SCHEMBL14286136 | 0.78 | MAPK1 (0.44) | DYRK1AMAPK1MAPK10MEN1KMT2A | |
| SCHEMBL14286160 | 0.73 | CHRM1 (0.42) | GSK3BKCNH2CHRM1MAPK1MAPK10 | |
| SCHEMBL14286135 | 0.73 | ROCK2 (0.41) | GSK3BKCNH2CHRM1LYNGRK2 | |
| SCHEMBL14286139 | 0.73 | ROCK2 (0.40) | GSK3BKCNH2CHRM1LYNGRK2 | |
| SCHEMBL14286127 | 0.72 | GSK3B (0.56) | GSK3BKCNH2MAPK1MAPK10MEN1 | |
| SCHEMBL14286151 | 0.71 | ADORA2A (0.39) | CHRM1MAPK1MAPK10ADORA2AADORA1 | |
| SCHEMBL14278769 | 0.70 | GSK3B (0.55) | GSK3BKCNH2MAPK1MAPK10MEN1 | |
| SCHEMBL5133542 | 0.68 | GSK3B (0.54) | GSK3BKCNH2MAPK1MAPK10MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7314885-B2 | Pyrrole compounds useful as kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-01-01 | — | — | US | disclosed |
| US-7314885-B2 | Pyrrole compounds useful as kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-01-01 | — | — | US | disclosed |