Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.73 |
| ▸ | ENPP3 | O14638 | 3/20 | 0.70 |
| ▸ | KDR | P35968 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | MAPT | P10636 | 5/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | HPGD | P15428 | 3/20 | 0.63 |
| ▸ | THRB | P10828 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | PDE5A | O76074 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | PDE1A | P54750 | 1/20 | 0.59 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL7918566 | 0.95 | ENPP3 (0.76) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7904940 | 0.94 | ENPP3 (0.70) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL8021598 | 0.89 | NPSR1 (0.79) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7912137 | 0.87 | NPSR1 (0.56) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL26115285 | 0.85 | MAPT (0.83) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7912100 | 0.85 | MAPT (0.81) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7914880 | 0.85 | MAPT (0.60) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7913348 | 0.85 | KDR (0.69) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7913363 | 0.85 | NPSR1 (0.57) | NPSR1ENPP3KDRALDH1A1MAPT | |
| SCHEMBL7905054 | 0.85 | NPSR1 (0.57) | NPSR1ENPP3KDRALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6207666-B1 | TREATING PRECANCEROUS LESIONS BY ADMINISTERING 4-PHENYLPHTHALAZINE DERIVATIVE | CELL PATHWAYS, INC. | 2001-03-27 | — | — | US | disclosed |