Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 18/20 | 0.44 |
| ▸ | CDK9 | P50750 | 11/20 | 0.42 |
| ▸ | CCNK | O75909 | 4/20 | 0.42 |
| ▸ | CDK14 | O94921 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.42 |
| ▸ | CDK16 | Q00536 | 2/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | CDK7 | P50613 | 1/20 | 0.42 |
| ▸ | CCNH | P51946 | 1/20 | 0.42 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | CCNY | Q8ND76 | 1/20 | 0.42 |
| ▸ | CDK17 | Q00537 | 1/20 | 0.41 |
| ▸ | CDK18 | Q07002 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1192586 | 0.85 | CCNT1 (0.58) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL1192583 | 0.85 | CCNT1 (0.58) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL12465812 | 0.82 | CDK9 (0.35) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL1192168 | 0.79 | CCNT1 (0.58) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL1192167 | 0.79 | CCNT1 (0.58) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL12465861 | 0.77 | CDK9 (0.46) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL12465951 | 0.77 | CCNT1 (0.62) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL12465949 | 0.77 | CCNT1 (0.62) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL1192509 | 0.75 | CCNT1 (0.61) | CCNT1CDK9CCNKCDK14CDK1 | |
| SCHEMBL1192507 | 0.75 | CCNT1 (0.61) | CCNT1CDK9CCNKCDK14CDK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2668162-A1 | SUBSTITUTED BI-HETEROARYL COMPOUNDS AS CDK9 INHIBITORS AND THEIR USES | Novartis AG (CH) | 2013-12-04 | — | — | EP | disclosed |
| WO-2012101062-A1 | SUBSTITUTED BI-HETEROARYL COMPOUNDS AS CDK9 INHIBITORS AND THEIR USES | NOVARTIS AG (CH) | 2012-08-02 | — | — | WO | disclosed |