Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.55 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.48 |
| ▸ | CFTR | P13569 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | QPCT | Q16769 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 3/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7371810 | 0.88 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL7379249 | 0.84 | PDE5A (0.38) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL7380388 | 0.82 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL7371005 | 0.80 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL14286203 | 0.71 | CYP1A2 (1.00) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL7371812 | 0.70 | KDM4E (0.52) | CYP1A2CYP3A4CYP2C19CYP1A1CYP1B1 | |
| SCHEMBL6132106 | 0.68 | PIK3CD (0.47) | CYP1A2CYP3A4CYP2C19NCOA1NCOA3 | |
| SCHEMBL7375040 | 0.68 | TERT (0.65) | CYP1A2CYP3A4CYP2C19CYP1A1CYP1B1 | |
| SCHEMBL7380070 | 0.68 | HPGD (0.65) | CYP1A2CYP3A4CYP2C19CYP1A1CYP1B1 | |
| SCHEMBL7375563 | 0.66 | TERT (0.52) | CYP1A2CYP3A4CYP2C19CYP1A1CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1115718-A1 | HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017184-A1 | HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-03-30 | — | — | WO | disclosed |