Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.42 |
| ▸ | GHSR | Q92847 | 5/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 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 | |
|---|---|---|---|---|
| SCHEMBL5877630 | 0.90 | CYP2D6 (0.49) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5877135 | 0.89 | ABCC1 (0.47) | CYP2D6ABCC1ALDH1A1PLA2G1BNPSR1 | |
| SCHEMBL5877473 | 0.88 | CYP2D6 (0.46) | CYP2D6GHSRKCNH2CYP3A4ALDH1A1 | |
| SCHEMBL5877626 | 0.85 | ABCC1 (0.52) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5878279 | 0.85 | CYP2D6 (0.45) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5877732 | 0.83 | ABCC1 (0.52) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5877867 | 0.83 | GHSR (0.54) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5877811 | 0.82 | ABCC1 (0.46) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5876953 | 0.82 | ABCC1 (0.50) | CYP2D6GHSRKCNH2CYP3A4ABCC1 | |
| SCHEMBL5877870 | 0.81 | ABCC1 (0.48) | CYP2D6GHSRKCNH2CYP3A4ABCC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7060706-B1 | Quinazolinones | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2006-06-13 | — | — | US | disclosed |