Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | KLF10 | Q13118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9080434 | 0.88 | NR1I2 (0.32) | KIF11CYP2D6NR1I2 | |
| SCHEMBL9701313 | 0.70 | CYP2D6 (0.35) | KIF11CYP2D6GPR84NR1I2MEN1 | |
| SCHEMBL9967889 | 0.67 | HSD17B10 (0.41) | ALDH1A1CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL10409091 | 0.67 | ALDH1A1 (0.54) | KIF11CYP2D6NR1I2MEN1POLB | |
| SCHEMBL19798852 | 0.66 | CYP2D6 (0.42) | KIF11CYP2D6GPR84NR1I2MEN1 | |
| SCHEMBL15066839 | 0.64 | PTPN1 (0.41) | KIF11CYP2D6ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL9138077 | 0.64 | CYP2D6 (0.33) | KIF11CYP2D6MEN1GAAKMT2A | |
| SCHEMBL6044383 | 0.64 | MRGPRX4 (0.49) | — | |
| SCHEMBL8954235 | 0.64 | ALDH1A1 (0.33) | KIF11CYP2D6ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL22275799 | 0.63 | KLF10 (0.53) | KIF11CYP2D6MEN1GAAKMT2A |
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-0550566-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS (US) | 1993-07-14 | — | — | EP | disclosed |
| WO-1992005153-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS, INC. (US) | 1992-04-02 | — | — | WO | disclosed |