Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 3/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16199101 | 1.00 | CCNT1 (0.38) | CCNT1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL16199046 | 0.91 | TLR7 (0.38) | CCNT1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL16199111 | 0.91 | TLR7 (0.38) | CCNT1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL16199104 | 0.91 | TLR7 (0.38) | CCNT1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL16199027 | 0.91 | TLR7 (0.38) | CCNT1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL16199021 | 0.89 | PDE5A (0.36) | HTR3APDE5AMGLLAURKAAURKB | |
| SCHEMBL16199045 | 0.89 | PDE5A (0.36) | HTR3APDE5AMGLLAURKAAURKB | |
| SCHEMBL16199115 | 0.89 | PDE5A (0.36) | HTR3APDE5AMGLLAURKAAURKB | |
| SCHEMBL16199110 | 0.89 | PDE5A (0.36) | HTR3APDE5AMGLLAURKAAURKB | |
| SCHEMBL16199043 | 0.89 | PDE5A (0.37) | CCNT1CDK4CCNA2CCND1CDK2 |
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-8871774-B2 | Inhibitors of influenza viruses replication | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-28 | — | — | US | disclosed |