Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18960605 | 0.86 | KMT2A (0.39) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20733760 | 0.84 | ALDH1A1 (0.37) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18852236 | 0.83 | TNKS2 (0.38) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL17725990 | 0.80 | KDM4E (0.33) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18643822 | 0.77 | — | — | |
| SCHEMBL18731724 | 0.76 | MAPT (0.40) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22428525 | 0.75 | NOTUM (0.38) | — | |
| SCHEMBL23511576 | 0.75 | — | — | |
| SCHEMBL19486766 | 0.75 | MAPK9 (0.39) | — | |
| SCHEMBL18786172 | 0.75 | ALDH1A1 (0.43) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 |
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-2019031605-A1 | FUSED RING COMPOUND | 東ソー株式会社 | 2019-02-14 | — | — | WO | disclosed |