Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.55 |
| ▸ | BACE1 | P56817 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 6/20 | 0.51 |
| ▸ | APP | P05067 | 5/20 | 0.51 |
| ▸ | PPARG | P37231 | 3/20 | 0.51 |
| ▸ | PPARA | Q07869 | 2/20 | 0.51 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | SNCA | P37840 | 1/20 | 0.51 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.51 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL13393656 | 0.85 | APP (0.58) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL29761579 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL14031835 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL30508970 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL29610312 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL31079439 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL15246486 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL31079540 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL29761554 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP | |
| SCHEMBL30196690 | 0.84 | VKORC1 (0.63) | VKORC1PTPN1BACE1MAOBAPP |
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-2019059344-A1 | CHEMICALLY ACTIVATED WATER-SOLUBLE PRODRUG | 大日本住友製薬株式会社 | 2019-03-28 | — | — | WO | disclosed |