Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PDE5A | O76074 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7282577 | 0.81 | CYP2C19 (0.75) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL11254135 | 0.80 | KIF11 (0.39) | PDE3BPDE3AMAPK14KIF11 | |
| SCHEMBL11241215 | 0.78 | KIF11 (0.37) | NPSR1PDE3BPDE3ALMNAHPGD | |
| SCHEMBL11236432 | 0.77 | PDE3B (0.51) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL11232696 | 0.77 | CYP2C19 (0.50) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL11241603 | 0.75 | PDE3B (0.53) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL11242799 | 0.74 | PDE3B (0.49) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL11224232 | 0.74 | CYP2C19 (0.47) | CYP2C19CYP1A2CYP2C9NPSR1PDE3B | |
| SCHEMBL9984671 | 0.73 | ALDH1A1 (0.54) | CYP2C19CYP1A2CYP2C9NPSR1KDM4E | |
| SCHEMBL31440794 | 0.73 | ALDH1A1 (0.54) | CYP2C19CYP1A2CYP2C9NPSR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4361568-A | 5-(Pyridinyl)-1H-pyrazolo[3,4-b]pyridin-3-amines and their cardiotonic use | STERLING DRUG INC. (US) | 1982-11-30 | — | — | US | disclosed |
| US-4264603-A | 5-(Pyridinyl)-1H-pyrazolo[3,4-b]pyridine-3-amines, their use as cardiotonics and their preparation | STERLING DRUG INC. (US) | 1981-04-28 | — | — | US | disclosed |