Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 12/20 | 0.44 |
| ▸ | CDK1 | P06493 | 12/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 12/20 | 0.44 |
| ▸ | CDK4 | P11802 | 3/20 | 0.42 |
| ▸ | CCND1 | P24385 | 3/20 | 0.42 |
| ▸ | CCND2 | P30279 | 1/20 | 0.42 |
| ▸ | CCND3 | P30281 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 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 | |
|---|---|---|---|---|
| SCHEMBL343335 | 0.86 | AURKA (0.43) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL15428771 | 0.85 | CDK4 (0.44) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL343810 | 0.83 | CDK4 (0.49) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL15428739 | 0.83 | JAK1 (0.44) | AURKAJAK3JAK1 | |
| SCHEMBL343483 | 0.83 | AURKA (0.46) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL343484 | 0.83 | AURKA (0.46) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL343334 | 0.81 | AURKA (0.41) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL15428702 | 0.80 | CDK1 (0.41) | AURKACDK1CCNB1CDK4CCND1 | |
| SCHEMBL15428749 | 0.80 | JAK1 (0.47) | JAK3JAK1 | |
| SCHEMBL15428718 | 0.79 | CDK2 (0.47) | AURKACDK1CCNB1CCND3JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| US-8637529-B2 | Pyrazolo[3,4-d]pyrimidine compounds | AbbYie Inc. (US) | 2014-01-28 | — | — | US | disclosed |