Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 5/20 | 0.48 |
| ▸ | PRKCQ | Q04759 | 13/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | MATK | P42679 | 1/20 | 0.41 |
| ▸ | FRK | P42685 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1266942 | 0.82 | PRKCQ (0.57) | PIN1PRKCQMAPT | |
| SCHEMBL3847008 | 0.78 | PRKCQ (0.51) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL2274362 | 0.76 | PIN1 (0.58) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL25192890 | 0.76 | CYP1A2 (0.50) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL30443923 | 0.76 | CYP1A2 (0.50) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL18757880 | 0.76 | NPC1 (0.62) | PIN1PRKCQCDK2GAAMAPT | |
| SCHEMBL3971786 | 0.74 | PIN1 (0.65) | PIN1PRKCQMAPT | |
| SCHEMBL6193447 | 0.73 | PRKCQ (0.53) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL3847319 | 0.73 | PRKCQ (0.60) | PIN1PRKCQCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL29250559 | 0.73 | PIN1 (0.45) | PIN1PRKCQCYP3A4CYP2D6GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008060301-A1 | 7-SUBSTITUTED PURINE DERIVATIVES FOR IMMUNOSUPPRESSION | PHARMACOPEIA , LLC (US) | 2008-05-22 | — | — | WO | disclosed |