Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 6/20 | 0.34 |
| ▸ | KRAS | P01116 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 4/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21734049 | 1.00 | RPS6KB1 (0.34) | RPS6KB1KRASHTR2CAKT1DRD2 | |
| SCHEMBL30177923 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL21733799 | 0.84 | KRAS (0.39) | RPS6KB1KRASAKT1 | |
| SCHEMBL30178136 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL30177770 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL21733415 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL21733413 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL21733417 | 0.84 | KRAS (0.46) | KRAS | |
| SCHEMBL21722224 | 0.83 | KRAS (0.35) | RPS6KB1KRASHTR2CAKT1DRD2 | |
| SCHEMBL21733766 | 0.76 | KRAS (0.44) | KRAS |
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 |
|---|---|---|---|---|---|---|---|
| CN-112119075-B | Condensed ring compound | 豪夫迈·罗氏有限公司 | 2024-03-12 | — | — | CN | disclosed |