Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 7/20 | 0.52 |
| ▸ | BTK | Q06187 | 5/20 | 0.47 |
| ▸ | JAK3 | P52333 | 4/20 | 0.47 |
| ▸ | WEE1 | P30291 | 3/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.42 |
| ▸ | GSK3A | P49840 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17827722 | 0.90 | RPS6KA3 (0.52) | RPS6KA3BTKJAK3WEE1SRC | |
| Hydrochloric Acid SCHEMBL16245574 | 0.89 | RPS6KA3 (0.51) | RPS6KA3BTKJAK3WEE1SRC | |
| SCHEMBL17827723 | 0.87 | RPS6KA3 (0.51) | RPS6KA3BTKJAK3WEE1SRC | |
| Hydrochloric Acid SCHEMBL16245564 | 0.86 | RPS6KA3 (0.50) | RPS6KA3BTKJAK3WEE1SRC | |
| SCHEMBL16245546 | 0.84 | RPS6KA3 (0.57) | RPS6KA3BTKJAK3WEE1SRC | |
| SCHEMBL16264903 | 0.83 | RPS6KA3 (0.47) | RPS6KA3BTKJAK3GSK3AGSK3B | |
| SCHEMBL17827725 | 0.82 | RPS6KA3 (0.56) | RPS6KA3BTKJAK3WEE1SRC | |
| Hydrochloric Acid SCHEMBL16245583 | 0.81 | RPS6KA3 (0.55) | RPS6KA3BTKJAK3WEE1SRC | |
| SCHEMBL16264847 | 0.79 | JAK2 (0.47) | RPS6KA3BTKJAK3WEE1SRC | |
| Hydrochloric Acid SCHEMBL16245600 | 0.78 | JAK2 (0.46) | RPS6KA3BTKJAK3WEE1SRC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014180524-A1 | MACROCYCLES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2014-11-13 | — | — | WO | disclosed |