Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.48 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.48 |
| ▸ | WNT3A | P56704 | 2/20 | 0.48 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9557967 | 0.99 | HPGD (0.51) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL6344166 | 0.89 | THRA (0.55) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL6340900 | 0.89 | THRA (0.55) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL27200216 | 0.87 | CTNNB1 (0.63) | ALDH1A1CYP1A2CYP2C19CTNNB1WNT3A | |
| SCHEMBL5355533 | 0.87 | CTNNB1 (0.63) | ALDH1A1CYP1A2CYP2C19CTNNB1WNT3A | |
| SCHEMBL9119840 | 0.85 | CTNNB1 (0.65) | ALDH1A1CYP1A2CYP2C19CTNNB1WNT3A | |
| SCHEMBL6348421 | 0.84 | HPGD (0.51) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL6543390 | 0.83 | PTPN1 (0.62) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL30682871 | 0.81 | HPGD (0.75) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL9558005 | 0.81 | ALDH1A1 (0.54) | HPGDALDH1A1CYP1A2CYP2C19HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0384350-B1 | DIHYDROXY NAPHTHALENE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-28 | — | — | EP | disclosed |
| EP-0384350-A1 | Dihydroxy naphthalene derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1990-08-29 | — | — | EP | disclosed |
| US-4937371-A | INHIBITING LIPOXYGENASE | HOFFMANN-LA ROCHE INC. (US) | 1990-06-26 | — | — | US | disclosed |