Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.34 |
| ▸ | RORA | P35398 | 2/20 | 0.34 |
| ▸ | RORC | P51449 | 2/20 | 0.34 |
| ▸ | RORB | Q92753 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.31 |
| ▸ | POLB | P06746 | 3/20 | 0.31 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20115892 | 1.00 | CYP1A2 (0.35) | CYP1A2CYP2D6CYP2C19PGRRORA | |
| SCHEMBL20116773 | 0.98 | PGR (0.35) | CYP1A2CYP2D6CYP2C19PGRRORA | |
| SCHEMBL18707130 | 0.92 | PGR (0.32) | PGRRORARORCRORB | |
| SCHEMBL17115482 | 0.88 | HPGD (0.33) | CYP1A2CYP2D6CYP2C19RORCKDM4E | |
| SCHEMBL17115477 | 0.88 | HPGD (0.33) | CYP1A2CYP2D6CYP2C19RORCKDM4E | |
| SCHEMBL18707022 | 0.86 | HPGD (0.33) | RORCCNR2LMNAMAPK1MAPT | |
| SCHEMBL17115381 | 0.83 | PTGER4 (0.33) | RORCMAPK1 | |
| SCHEMBL17189940 | 0.82 | PTPN1 (0.41) | PGRRORARORCRORBCNR2 | |
| SCHEMBL15785780 | 0.81 | ALDH1A1 (0.41) | CYP1A2POLBL3MBTL1KDM4ELMNA | |
| SCHEMBL16920067 | 0.81 | ALDH1A1 (0.41) | CYP1A2POLBL3MBTL1KDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3119770-B1 | NEW DIBENZOFURANS AND DIBENZOTHIOPHENES | IDEMITSU KOSAN CO (JP) | 2018-05-02 | — | — | EP | disclosed |