Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 15/20 | 0.58 |
| ▸ | AKT1 | P31749 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15054552 | 0.76 | RPS6KB1 (0.81) | RPS6KB1AKT1AURKAEGLN1 | |
| SCHEMBL15054924 | 0.75 | RPS6KB1 (0.50) | RPS6KB1AKT1KDM4EAURKAPARP1 | |
| SCHEMBL15054551 | 0.75 | RPS6KB1 (0.52) | RPS6KB1AKT1KDM4EAURKAPARP1 | |
| SCHEMBL15054925 | 0.74 | RPS6KB1 (0.78) | RPS6KB1AKT1KDM4EAURKA | |
| SCHEMBL15059813 | 0.74 | RPS6KB1 (1.00) | RPS6KB1AKT1 | |
| SCHEMBL15073443 | 0.73 | RPS6KB1 (1.00) | RPS6KB1AKT1AURKA | |
| SCHEMBL15053947 | 0.69 | KDM4E (0.61) | RPS6KB1KDM4EPARP1EGLN1L3MBTL1 | |
| SCHEMBL20515237 | 0.68 | KDM4E (0.59) | RPS6KB1KDM4EAURKAPARP1EGLN1 | |
| SCHEMBL29448814 | 0.68 | KDM4E (0.59) | RPS6KB1KDM4EPARP1EGLN1L3MBTL1 | |
| SCHEMBL27767795 | 0.68 | KDM4E (0.64) | RPS6KB1KDM4EAURKAPARP1EGLN1 |
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 |