Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | BTK | Q06187 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | ITK | Q08881 | 2/20 | 0.36 |
| ▸ | CDK4 | P11802 | 2/20 | 0.36 |
| ▸ | CCND1 | P24385 | 2/20 | 0.36 |
| ▸ | CCND2 | P30279 | 2/20 | 0.36 |
| ▸ | CCND3 | P30281 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.35 |
| ▸ | MAT2A | P31153 | 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 | |
|---|---|---|---|---|
| SCHEMBL8287374 | 0.89 | PDE11A (0.40) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL5872005 | 0.88 | MAT2A (0.43) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL8285178 | 0.83 | KCNH3 (0.41) | PDE11ACYP1A2CLK4LMNAMAPK1 | |
| SCHEMBL8285172 | 0.83 | PDE11A (0.40) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL5872009 | 0.80 | PDE11A (0.44) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL5871661 | 0.79 | PDE11A (0.42) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL5871610 | 0.78 | MEN1 (0.43) | PDE11ABTKEGFRITKCYP1A2 | |
| SCHEMBL5872062 | 0.78 | PDE11A (0.44) | PDE11AGSK3BCDK4CCND1CCND2 | |
| SCHEMBL8287521 | 0.77 | PDE11A (0.40) | PDE11AGSK3BEGFRCDK4CCND1 | |
| SCHEMBL8287383 | 0.76 | PDE11A (0.41) | PDE11AGSK3BBTKEGFRCDK4 |
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 |