Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 13/20 | 0.59 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | LPL | P06858 | 1/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22734811 | 0.83 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL2094304 | 0.79 | CYP2A6 (0.50) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL13879062 | 0.77 | CYP2A6 (0.62) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL12270153 | 0.76 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL6320052 | 0.76 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL2094933 | 0.74 | CYP2A6 (0.42) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL12422714 | 0.74 | CYP2A6 (0.68) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL3609702 | 0.74 | CYP2A6 (1.00) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL12457156 | 0.73 | CYP2A6 (0.65) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL14003393 | 0.72 | CYP2A6 (0.53) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 |
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-3294744-B1 | INDACEN-4-ONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND POLYMERS CONTAINING THEM | ENI SPA (IT) | 2020-04-08 | — | — | EP | disclosed |