Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.57 |
| ▸ | WEE1 | P30291 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 11/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | ITK | Q08881 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCND2 | P30279 | 1/20 | 0.35 |
| ▸ | CCND3 | P30281 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8286091 | 0.90 | PDE11A (0.46) | PDE11AHCRTR1HCRTR2EGFRBTK | |
| SCHEMBL8287101 | 0.90 | PDE11A (0.60) | PDE11AWEE1HCRTR1HCRTR2 | |
| SCHEMBL8361753 | 0.89 | PDE11A (0.46) | PDE11AHCRTR1HCRTR2CNR2EGFR | |
| SCHEMBL8286349 | 0.89 | PDE11A (0.61) | PDE11AWEE1HCRTR1HCRTR2CNR1 | |
| SCHEMBL8287155 | 0.87 | PDE11A (0.59) | PDE11AWEE1HCRTR1HCRTR2CDK4 | |
| SCHEMBL8286350 | 0.86 | PDE11A (0.58) | PDE11AWEE1HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL8287215 | 0.86 | PDE11A (0.61) | PDE11AHCRTR1HCRTR2CYP3A4CYP2C9 | |
| SCHEMBL8287857 | 0.84 | PDE11A (0.56) | PDE11AWEE1HCRTR1HCRTR2CNR1 | |
| SCHEMBL8286351 | 0.84 | PDE11A (0.59) | PDE11AWEE1HCRTR1HCRTR2CNR1 | |
| SCHEMBL8287168 | 0.84 | PDE11A (0.56) | PDE11AHCRTR1HCRTR2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005091857-A2 | 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS | BAYER PHARMACEUTICALS CORPORATION (US) | 2005-10-06 | — | — | WO | disclosed |
| WO-2003027112-A1 | 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |