Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.32 |
| ▸ | GLRB | P48167 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9210237 | 0.84 | NR1I2 (0.44) | NR1I2CYP3A4CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL9200228 | 0.83 | NR1I2 (0.40) | NR1I2CYP3A4CYP2D6MEN1KMT2A | |
| SCHEMBL9862922 | 0.83 | CYP19A1 (0.48) | NR1I2CYP3A4CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL9862870 | 0.83 | CYP19A1 (0.48) | NR1I2CYP3A4CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL9207573 | 0.82 | NR1I2 (0.41) | NR1I2CYP3A4CYP2D6NMT1CYP1A2 | |
| SCHEMBL9705958 | 0.81 | NR1I2 (0.42) | NR1I2CYP3A4CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL10429394 | 0.81 | NR1I2 (0.40) | NR1I2CYP3A4CYP2D6NMT1CYP1A2 | |
| SCHEMBL10506062 | 0.80 | NR1I2 (0.41) | NR1I2CYP3A4CYP2D6NMT1CYP1A2 | |
| SCHEMBL9705948 | 0.80 | NR1I2 (0.43) | NR1I2CYP3A4CYP2D6NMT1CYP1A2 | |
| SCHEMBL9436214 | 0.80 | NR1I2 (0.43) | NR1I2CYP3A4CYP2D6CYP1A2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0207454-B1 | ISOXAZOLE AND FURAN DERIVATIVES, THEIR PREPARATION AND USE AS ANTIVIRAL AGENTS | STERLING WINTHROP INC. (US) | 1992-09-09 | — | — | EP | disclosed |
| EP-0207454-A2 | Isoxazole and furan derivatives, their preparation and use as antiviral agents | STERLING WINTHROP INC. (US) | 1987-01-07 | — | — | EP | disclosed |