Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | GRK6 | P43250 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 11/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | PDE6A | P16499 | 2/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL2078614 | 0.92 | EGFR (0.37) | CHEK1CYP3A4CYP2D6CYP2C9GRK6 | |
| SCHEMBL2078504 | 0.92 | EGFR (0.37) | CHEK1CYP3A4CYP2D6CYP2C9GRK6 | |
| SCHEMBL12428974 | 0.86 | — | — | |
| SCHEMBL2078242 | 0.84 | EGFR (0.38) | CHEK1HTR2ABACE1AURKARAB9A | |
| SCHEMBL2078499 | 0.84 | EGFR (0.38) | CHEK1CYP3A4CYP2D6CYP2C9GRK6 | |
| SCHEMBL2076349 | 0.82 | EGFR (0.39) | CHEK1MAPTRAB9A | |
| SCHEMBL2077481 | 0.81 | EGFR (0.37) | CHEK1GRK6MAPTGAAHTR2A | |
| SCHEMBL2076726 | 0.78 | MEN1 (0.37) | CHEK1MAPTRAB9A | |
| SCHEMBL2077542 | 0.78 | MAPT (0.37) | CYP3A4MAPTHPGDRAB9A | |
| SCHEMBL2077928 | 0.78 | RAB9A (0.38) | CHEK1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2351751-A1 | Substituted pyrazolopyrimidines | CEPHALON, INC. (US) | 2011-08-03 | — | — | EP | disclosed |