Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 5/20 | 0.64 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.64 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.64 |
| ▸ | CDK2 | P24941 | 3/20 | 0.64 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.64 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.64 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.64 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13220724 | 0.94 | CDK9 (0.60) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13220604 | 0.92 | CDK9 (0.58) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13220580 | 0.89 | CDK9 (0.74) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13202878 | 0.88 | CDK9 (0.80) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13952731 | 0.87 | CDK9 (0.59) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13220722 | 0.85 | CDK9 (0.57) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13220539 | 0.84 | CDK9 (0.55) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13202970 | 0.84 | CDK9 (0.61) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13175329 | 0.82 | CDK9 (0.64) | CDK9CDK5CDK5R1CDK2CCNT1 | |
| SCHEMBL13952912 | 0.82 | CDK9 (0.63) | CDK9CDK5CDK5R1CDK2CCNT1 |
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-7495000-B2 | Variolin derivatives and their use as antitumor agents | PHARMA MAR, S.A. (ES) | 2009-02-24 | — | — | US | disclosed |