Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 18/20 | 0.73 |
| ▸ | AKT1 | P31749 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15060263 | 0.85 | RPS6KB1 (1.00) | RPS6KB1AKT1 | |
| SCHEMBL15054900 | 0.79 | RPS6KB1 (1.00) | RPS6KB1AKT1 | |
| SCHEMBL28138008 | 0.76 | RPS6KB1 (0.87) | RPS6KB1AKT1 | |
| SCHEMBL15073600 | 0.76 | RPS6KB1 (1.00) | RPS6KB1AKT1 | |
| SCHEMBL18192371 | 0.73 | RPS6KB1 (0.80) | RPS6KB1AKT1 | |
| SCHEMBL28138005 | 0.73 | RPS6KB1 (0.60) | RPS6KB1 | |
| SCHEMBL28137984 | 0.73 | RPS6KB1 (0.60) | RPS6KB1 | |
| SCHEMBL28137986 | 0.73 | RPS6KB1 (0.60) | RPS6KB1 | |
| SCHEMBL15059122 | 0.72 | RPS6KB1 (1.00) | RPS6KB1AKT1 | |
| SCHEMBL15073438 | 0.72 | RPS6KB1 (1.00) | RPS6KB1AKT1 |
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-104169258-B | novel heterocyclic carboxamides as modulators of kinase activity | 默克专利有限公司 | 2017-03-01 | — | — | CN | disclosed |