Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 8/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 7/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.38 |
| ▸ | CDK4 | P11802 | 2/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.38 |
| ▸ | CCND1 | P24385 | 2/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK7 | P50613 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | CCNH | P51946 | 1/20 | 0.38 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5025187 | 0.93 | CDK2 (0.51) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL5029589 | 0.90 | CDK2 (0.42) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL17998701 | 0.81 | CDK2 (0.61) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL5029681 | 0.79 | GRM8 (0.47) | CDK2CCNE1CDK5CDK1CDK4 | |
| SCHEMBL2878400 | 0.77 | CCNE1 (0.44) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL1903375 | 0.77 | CCNE1 (0.44) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL15921777 | 0.76 | CA1 (0.50) | CDK2CCNE1CA1CA2CDK1 | |
| SCHEMBL21392355 | 0.75 | CCNE1 (0.45) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL28847719 | 0.73 | CCNE1 (0.44) | CDK2CCNE1CDK5CA1CA2 | |
| SCHEMBL19455034 | 0.73 | CA1 (0.43) | CA1CA2SMN1; SMN2LCKMAPKAPK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1299381-B1 | SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS | ASTRAZENECA AB (SE) | 2008-05-07 | — | — | EP | disclosed |