Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK10 | P53779 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 9/20 | 0.42 |
| ▸ | CDK2 | P24941 | 3/20 | 0.42 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CDK4 | P11802 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | CDK7 | P50613 | 2/20 | 0.42 |
| ▸ | CDK9 | P50750 | 2/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | CCNH | P51946 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 6/20 | 0.42 |
| ▸ | IKBKB | O14920 | 3/20 | 0.42 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | JUN | P05412 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13498354 | 0.86 | MAPK10 (0.49) | MAPK10CA2CDK2CDK1CDK4 | |
| SCHEMBL1633475 | 0.86 | MAPK10 (0.53) | MAPK10CA2CDK2CDK1CDK4 | |
| SCHEMBL1634634 | 0.85 | MAPK10 (0.48) | MAPK10CA2CDK2CDK1CDK4 | |
| SCHEMBL1634792 | 0.85 | MAPK10 (0.43) | MAPK10CA2CDK2CDK1CDK9 | |
| SCHEMBL1633211 | 0.84 | MAPK10 (0.48) | MAPK10CA2CDK2CDK1CDK4 | |
| SCHEMBL1632848 | 0.84 | CA2 (0.56) | MAPK10CA2CDK2CDK1CDK4 | |
| SCHEMBL1633149 | 0.83 | CA1 (0.48) | MAPK10CA2CDK2CDK1CDK9 | |
| SCHEMBL1633121 | 0.79 | MAPK10 (0.52) | MAPK10CA2CA1CA9CA12 | |
| SCHEMBL1632787 | 0.78 | JAK2 (0.45) | MAPK10CA2CDK2CDK1CDK9 | |
| SCHEMBL1631911 | 0.78 | MAPK10 (0.55) | MAPK10CA2CDK2CDK1KDR |
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 3 patents. 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 |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |