Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 3/20 | 0.44 |
| ▸ | AKT1 | P31749 | 8/20 | 0.32 |
| ▸ | KIT | P10721 | 2/20 | 0.32 |
| ▸ | ATR | Q13535 | 3/20 | 0.31 |
| ▸ | AKT2 | P31751 | 5/20 | 0.31 |
| ▸ | AKT3 | Q9Y243 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21733504 | 0.85 | KRAS (0.48) | KRASKITATR | |
| SCHEMBL21722284 | 0.82 | KRAS (0.65) | KRAS | |
| SCHEMBL21722208 | 0.80 | KRAS (0.48) | KRASATR | |
| SCHEMBL21243885 | 0.77 | KRAS (0.41) | KRASKITATR | |
| SCHEMBL21243891 | 0.76 | KIT (0.39) | KRASKIT | |
| SCHEMBL21243944 | 0.75 | KRAS (0.48) | KRASKITATR | |
| SCHEMBL21722212 | 0.75 | KRAS (0.40) | KRASKITATR | |
| SCHEMBL21733530 | 0.75 | KRAS (0.39) | KRASKITATR | |
| SCHEMBL21722422 | 0.75 | KRAS (0.60) | KRAS | |
| SCHEMBL21733673 | 0.71 | KRAS (0.52) | KRASAKT1AKT2AKT3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112119075-B | Condensed ring compound | 豪夫迈·罗氏有限公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-112119075-A | Fused ring compound | 豪夫迈·罗氏有限公司 | 2020-12-22 | — | — | CN | disclosed |