Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 7/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.40 |
| ▸ | CDK2 | P24941 | 6/20 | 0.40 |
| ▸ | CDK9 | P50750 | 6/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.40 |
| ▸ | CDK4 | P11802 | 4/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.40 |
| ▸ | CCND1 | P24385 | 4/20 | 0.40 |
| ▸ | CCND3 | P30281 | 4/20 | 0.40 |
| ▸ | CDK7 | P50613 | 4/20 | 0.40 |
| ▸ | CDK3 | Q00526 | 4/20 | 0.40 |
| ▸ | CDK6 | Q00534 | 4/20 | 0.40 |
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.38 |
| ▸ | SRC | P12931 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1633540 | 0.89 | CA1 (0.47) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL1633573 | 0.89 | CA1 (0.47) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL12764646 | 0.88 | CA1 (0.46) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL1633268 | 0.86 | CA1 (0.44) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL1633149 | 0.86 | CA1 (0.48) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL1633466 | 0.81 | CA1 (0.48) | CA2CA1CA9CDK1CCNT1 | |
| SCHEMBL1634792 | 0.81 | MAPK10 (0.43) | CA2CA1CA9CA4CDK1 | |
| SCHEMBL1633121 | 0.79 | MAPK10 (0.52) | CA2CA1CA9JAK2 | |
| SCHEMBL1632922 | 0.78 | JAK2 (0.48) | SRCJAK2JAK3PTK2NMT1 | |
| SCHEMBL1633492 | 0.77 | CDK2 (0.49) | CA2CA1CA9CA4CDK1 |
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 |