Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.35 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 2/20 | 0.33 |
| ▸ | GABRD | O14764 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.33 |
| ▸ | GABRE | P78334 | 2/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.33 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.33 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17402907 | 0.79 | CYP3A4 (0.45) | CYP3A4CYP1A2MAPTKMT2ACYP1A1 | |
| SCHEMBL19773528 | 0.76 | IDO1 (0.41) | IDO1TGFBR1AKR1C3AKR1C2MEN1 | |
| SCHEMBL5440688 | 0.74 | MAOA (0.42) | CYP3A4GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL8171792 | 0.72 | CYP3A4 (0.52) | CYP3A4CYP1A2MEN1MAPTKMT2A | |
| SCHEMBL24759166 | 0.72 | GABRP (0.43) | CYP3A4GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL3804537 | 0.71 | MAOA (0.56) | IDO1CYP3A4MEN1MAP4K4 | |
| SCHEMBL20108364 | 0.71 | RXRA (0.36) | CYP3A4GRIA1CACNG8CYP1A2MEN1 | |
| SCHEMBL3570882 | 0.70 | IDO1 (0.40) | IDO1CYP3A4GRIA1CACNG8TGFBR1 | |
| SCHEMBL3786065 | 0.70 | TAAR1 (0.52) | IDO1CYP3A4MEN1MAPTKMT2A | |
| SCHEMBL16429717 | 0.68 | RPS6KA3 (0.47) | CYP3A4MAPTKMT2A |
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-2964635-B1 | ANTIVIRAL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2018-05-02 | — | — | EP | disclosed |