Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | PARP1 | P09874 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RGS12 | O14924 | 1/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | PRKCG | P05129 | 1/20 | 0.46 |
| ▸ | PRKCB | P05771 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3572468 | 1.00 | GSK3B (0.52) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3560027 | 0.91 | GSK3B (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3560022 | 0.91 | GSK3B (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3569212 | 0.87 | PRKD3 (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3573931 | 0.87 | PPOX (0.46) | GSK3BALDH1A1PARP1MAPTMAPK1 | |
| SCHEMBL3573929 | 0.87 | PPOX (0.46) | GSK3BALDH1A1PARP1MAPTMAPK1 | |
| SCHEMBL3569211 | 0.87 | PRKD3 (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3564333 | 0.87 | GSK3B (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3566410 | 0.87 | GSK3B (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 | |
| SCHEMBL3564332 | 0.87 | GSK3B (0.46) | GSK3BALDH1A1PARP1LMNASMN1; SMN2 |
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-7713994-B2 | Substituted isoquinoline-1,3(2H,4H)-diones, 1-thioxo,1,4-dihydro-2H-isoquinoline-3-ones and 1,4-dihyro-3 (2H)-isoquinolones and methods of use thereof | WYETH LLC (US) | 2010-05-11 | — | — | US | claimed |