Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 1/20 | 0.62 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.62 |
| ▸ | CDK2 | P24941 | 9/20 | 0.58 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.58 |
| ▸ | CA1 | P00915 | 5/20 | 0.53 |
| ▸ | CA2 | P00918 | 5/20 | 0.53 |
| ▸ | CA9 | Q16790 | 5/20 | 0.53 |
| ▸ | CA12 | O43570 | 4/20 | 0.53 |
| ▸ | CA7 | P43166 | 3/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CDK1 | P06493 | 1/20 | 0.49 |
| ▸ | CDK9 | P50750 | 1/20 | 0.49 |
| ▸ | CCNK | O75909 | 3/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.47 |
| ▸ | CDK7 | P50613 | 3/20 | 0.47 |
| ▸ | CCNH | P51946 | 3/20 | 0.47 |
| ▸ | MNAT1 | P51948 | 3/20 | 0.47 |
| ▸ | CDK12 | Q9NYV4 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3502719 | 0.92 | MTOR (0.62) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1632195 | 0.91 | CDK2 (0.56) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1632895 | 0.89 | CDK2 (0.53) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1631321 | 0.85 | CDK2 (0.50) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1633843 | 0.84 | MAPK10 (0.54) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1632704 | 0.84 | CDK2 (0.50) | CDK2CCNE1CA1CA2CA9 | |
| SCHEMBL1633518 | 0.84 | SYK (0.53) | CDK2CCNE1CA1CA2CA9 | |
| SCHEMBL1869926 | 0.83 | MTOR (0.52) | MTORSMG1CDK2CCNE1CA1 | |
| SCHEMBL1570959 | 0.81 | CDK2 (0.50) | CDK2CCNE1CA1CA2CA9 | |
| SCHEMBL1633839 | 0.81 | CDK2 (0.52) | CDK2CCNE1CA1CA2CA9 |
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 |