Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.33 |
| ▸ | SCARB1 | Q8WTV0 | 1/20 | 0.33 |
| ▸ | FABP6 | P51161 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555393 | 0.89 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL8552753 | 0.86 | NR1I2 (0.66) | NR1I2CYP3A4CYP2D6MAPTHDAC1 | |
| SCHEMBL8552166 | 0.86 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6SMN1; SMN2MAPT | |
| SCHEMBL9087864 | 0.80 | NR1I2 (0.47) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL6974407 | 0.79 | NR1I2 (0.47) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL8824435 | 0.79 | NR1I2 (0.49) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL8687271 | 0.78 | NR1I2 (0.46) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL8670645 | 0.77 | CYP3A4 (0.48) | NR1I2CYP3A4CYP2D6CA12CA1 | |
| SCHEMBL8551728 | 0.77 | NR1I2 (0.34) | NR1I2CYP3A4CYP2D6SMN1; SMN2MAPT | |
| SCHEMBL8553518 | 0.77 | NR1I2 (0.49) | NR1I2CYP3A4CYP2D6L3MBTL1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5846986-A | Therapeutic phenoxyalkylazoles and phenoxyalkylazines | SANOFI (FR) | 1998-12-08 | — | — | US | disclosed |
| US-5721261-A | TREATING PICORNAVIRUS INFECTIONS | SANOFI PHARMACEUTICALS, INC. (US) | 1998-02-24 | — | — | US | disclosed |