Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 11/20 | 0.51 |
| ▸ | CDK9 | P50750 | 11/20 | 0.51 |
| ▸ | ALK | Q9UM73 | 8/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | MET | P08581 | 4/20 | 0.46 |
| ▸ | INSR | P06213 | 1/20 | 0.45 |
| ▸ | ROS1 | P08922 | 2/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.45 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | CDK4 | P11802 | 1/20 | 0.45 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.45 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3959009 | 0.88 | ALK (0.51) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL3953087 | 0.85 | ALK (0.51) | CDK7CDK9ALKINSRAURKA | |
| SCHEMBL3959979 | 0.84 | CDK7 (0.50) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL12862540 | 0.82 | CDK7 (0.66) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL3954082 | 0.82 | ALK (0.55) | CDK7CDK9ALKHDAC1MET | |
| Hydrochloric Acid SCHEMBL30817651 | 0.81 | CDK7 (0.64) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL3958857 | 0.81 | ALK (0.54) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL31174012 | 0.78 | TTK (0.66) | CDK7CDK9ALKINSRIGF1R | |
| SCHEMBL1493586 | 0.78 | ALK (0.51) | CDK7CDK9ALKHDAC1MET | |
| SCHEMBL30156784 | 0.78 | CDK9 (0.63) | CDK7CDK9ALKHDAC1MET |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009032703-A1 | 2- (HET) ARYLAMINO-6-AMINOPYRIDINE DERIVATIVES AND FUSED FORMS THEREOF AS ANAPLASTIC LYMPHOMA KINASE INHIBITORS | IRM LLC (BM) | 2009-03-12 | — | — | WO | disclosed |
| WO-2009032694-A1 | AMINO SUBSTITUTED PYRIMIDINE, PYROLLOPYRIDINE AND PYRAZOLOPYRIMIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS AND IN TREATING PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS | DANA FARBER CANCER INSTITUTE (US) | 2009-03-12 | — | — | WO | disclosed |
| WO-2009032703-A1 | 2- (HET) ARYLAMINO-6-AMINOPYRIDINE DERIVATIVES AND FUSED FORMS THEREOF AS ANAPLASTIC LYMPHOMA KINASE INHIBITORS | IRM LLC (BM) | 2009-03-12 | — | — | WO | disclosed |