Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 15/20 | 0.51 |
| ▸ | CDK1 | P06493 | 2/20 | 0.45 |
| ▸ | CDK4 | P11802 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 7/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.43 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | CCNH | P51946 | 1/20 | 0.43 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.43 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12501692 | 1.00 | CDK9 (0.51) | CDK9CDK1CDK4CDK2CCNT1 | |
| SCHEMBL1944753 | 0.87 | CCNT1 (0.54) | CDK9CDK4CDK2CCNT1NTRK1 | |
| SCHEMBL1944749 | 0.87 | CCNT1 (0.54) | CDK9CDK4CDK2CCNT1NTRK1 | |
| SCHEMBL1439644 | 0.87 | CDK9 (0.55) | CDK9CDK1CDK4CDK2CCNT1 | |
| SCHEMBL1439640 | 0.87 | CDK9 (0.55) | CDK9CDK1CDK4CDK2CCNT1 | |
| SCHEMBL1439849 | 0.86 | USP30 (0.50) | CDK9CCNT1MAPK8MAPK10MAPK14 | |
| SCHEMBL1439848 | 0.86 | USP30 (0.50) | CDK9CCNT1MAPK8MAPK10MAPK14 | |
| SCHEMBL12827050 | 0.86 | CDK9 (0.46) | CDK9NTRK1MAPK8MAPK10MAPK14 | |
| SCHEMBL16042236 | 0.85 | CDK9 (0.46) | CDK9NTRK1MAPK8MAPK10MAPK14 | |
| SCHEMBL16042238 | 0.85 | CDK9 (0.46) | CDK9NTRK1MAPK8MAPK10MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012101063-A1 | N-ACYL PYRIDINE BIARYL COMPOUNDS AND THEIR USES | NOVARTIS AG (CH) | 2012-08-02 | — | — | WO | disclosed |