Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 4/20 | 0.42 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | CCND1 | P24385 | 5/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 5/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.34 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28698359 | 0.82 | CCND1 (0.40) | RPS6KA5DYRK1ACCND1CDK6RPS6KA4 | |
| SCHEMBL28678594 | 0.81 | RPS6KA5 (0.42) | RPS6KA5DYRK1ACCND1CDK6RPS6KA4 | |
| SCHEMBL24710243 | 0.81 | CCND1 (0.51) | RPS6KA5DYRK1ACCND1CDK6 | |
| SCHEMBL1263981 | 0.70 | RPS6KA5 (0.43) | RPS6KA5DYRK1ARPS6KA4CYP1A2MAPT | |
| SCHEMBL24710411 | 0.70 | CCND1 (0.51) | RPS6KA5DYRK1ACCND1CDK6 | |
| SCHEMBL28685240 | 0.69 | RPS6KA5 (0.44) | RPS6KA5DYRK1ARPS6KA4MAPK14MAPT | |
| SCHEMBL20354374 | 0.69 | ACVR1 (0.58) | — | |
| SCHEMBL24710134 | 0.69 | CCND1 (0.54) | CCND1CDK6 | |
| SCHEMBL30337550 | 0.69 | CDK5 (0.51) | CYP1A2MAPT | |
| SCHEMBL518274 | 0.69 | CDK5 (0.51) | CYP1A2MAPT |
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-113248500-B | Azaindolopyrimidineamine heterocyclic compounds, and preparation method and application thereof | 中国药科大学 | 2021-10-19 | — | — | CN | disclosed |
| CN-113248500-A | Azaindolopyrimidineamine heterocyclic compounds, and preparation method and application thereof | 中国药科大学 | 2021-08-13 | — | — | CN | disclosed |