Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.48 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.48 |
| ▸ | PIK3C2G | O75747 | 1/20 | 0.48 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 6/20 | 0.40 |
| ▸ | CDK1 | P06493 | 5/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.40 |
| ▸ | CDK7 | P50613 | 4/20 | 0.40 |
| ▸ | CDK9 | P50750 | 4/20 | 0.40 |
| ▸ | CCNH | P51946 | 4/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | TTK | P33981 | 2/20 | 0.39 |
| ▸ | BMPR2 | Q13873 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1632131 | 0.85 | BMPR2 (0.52) | AURKAAURKBCDK2CDK1CCNA2 | |
| SCHEMBL1632814 | 0.85 | CDK2 (0.52) | CDK2CDK1CCNA2CCNT1CCNB1 | |
| SCHEMBL1634895 | 0.79 | CA1 (0.51) | CDK2CA2CDK5CA1 | |
| SCHEMBL1633395 | 0.77 | CDK2 (0.49) | LRRK2CDK2CDK1CCNA2CCNT1 | |
| SCHEMBL1631342 | 0.75 | CDK2 (0.45) | LRRK2CDK2CDK1CCNA2CCNT1 | |
| SCHEMBL1634282 | 0.75 | ACVR1 (0.52) | AURKAAURKBLRRK2CDK2CDK1 | |
| SCHEMBL14146552 | 0.74 | CDK2 (0.50) | AURKAAURKBPIK3CDPIK3C2GPIK3CG | |
| SCHEMBL27229147 | 0.74 | NPC1 (0.39) | AURKAAURKBPIK3CDPIK3C2GPIK3CG | |
| SCHEMBL21556096 | 0.72 | POLB (0.46) | CDK2CDK1CCNA2CA2CA1 | |
| SCHEMBL1633872 | 0.72 | CDK2 (0.52) | CDK2CDK1CCNA2CCNT1CCNB1 |
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-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |