Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.52 |
| ▸ | CA1 | P00915 | 5/20 | 0.52 |
| ▸ | CA7 | P43166 | 5/20 | 0.52 |
| ▸ | CA9 | Q16790 | 4/20 | 0.52 |
| ▸ | GSK3B | P49841 | 3/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.42 |
| ▸ | TRPC3 | Q13507 | 2/20 | 0.42 |
| ▸ | TRPC7 | Q9HCX4 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | F13A1 | P00488 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953550 | 0.92 | GSK3B (0.52) | CA2CA1CA7CA9GSK3B | |
| SCHEMBL14043203 | 0.89 | TRPC3 (0.44) | GSK3BENPP2TRPC3TRPC7CYP2C9 | |
| SCHEMBL13305198 | 0.86 | GSK3B (0.56) | GSK3BTRPC3TRPC7CYP2C9CYP3A4 | |
| SCHEMBL13118082 | 0.85 | GSK3B (0.51) | CA2CA1CA7CA9GSK3B | |
| SCHEMBL13305170 | 0.84 | TRPC3 (0.43) | GSK3BENPP2TRPC3TRPC7CYP2C9 | |
| SCHEMBL12953650 | 0.82 | GSK3B (0.54) | GSK3BTRPC3TRPC7CYP2C9RAB9A | |
| SCHEMBL13305093 | 0.82 | TRPC3 (0.41) | GSK3BENPP2TRPC3TRPC7CYP2C9 | |
| SCHEMBL13305680 | 0.80 | GSK3B (0.55) | CA2CA1CA9GSK3B | |
| SCHEMBL12953476 | 0.80 | GSK3B (0.52) | GSK3BTRPC3TRPC7CYP2C9CYP3A4 | |
| SCHEMBL12953454 | 0.79 | CDK2 (0.54) | GSK3BTRPC3TRPC7CYP2C9GRIN2B |
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-1537116-B1 | PYRAZOLOPYRIMIDINES SUITABLE FOR THE TREATMENT OF CANCER DISEASES | SCHERING CORP (US) | 2010-06-02 | — | — | EP | disclosed |