Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8737617 | 0.82 | NAPRT (0.58) | NAPRTCYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL22024034 | 0.81 | NAPRT (0.58) | NAPRTCYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL6222089 | 0.81 | NAPRT (0.68) | NAPRTCYP1A2CYP3A4CYP2C9TBXAS1 | |
| SCHEMBL29430342 | 0.79 | NAPRT (1.00) | NAPRTCYP1A2CYP3A4CYP2C9TBXAS1 | |
| SCHEMBL48609 | 0.79 | NAPRT (1.00) | NAPRTCYP1A2CYP3A4CYP2C9TBXAS1 | |
| SCHEMBL8603770 | 0.79 | NAPRT (0.66) | NAPRTCYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL610066 | 0.79 | NAPRT (0.55) | NAPRTCYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL22024031 | 0.79 | NAPRT (0.55) | NAPRTCYP1A2CYP3A4CYP2C9CYP2D6 | |
| Hydrochloric Acid SCHEMBL5332088 | 0.78 | NAPRT (0.96) | NAPRTCYP1A2CYP3A4CYP2C9TBXAS1 | |
| SCHEMBL986770 | 0.78 | NAPRT (0.96) | NAPRTCYP1A2CYP3A4CYP2C9TBXAS1 |
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-2007036733-A1 | PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-04-05 | — | — | WO | disclosed |