Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 20/20 | 0.66 |
| ▸ | INSR | P06213 | 19/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.66 |
| ▸ | NPM1 | P06748 | 9/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | ABL1 | P00519 | 2/20 | 0.61 |
| ▸ | EGFR | P00533 | 2/20 | 0.61 |
| ▸ | LCK | P06239 | 2/20 | 0.61 |
| ▸ | RET | P07949 | 2/20 | 0.61 |
| ▸ | IGF1R | P08069 | 2/20 | 0.61 |
| ▸ | MET | P08581 | 2/20 | 0.61 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.61 |
| ▸ | CDK2 | P24941 | 2/20 | 0.61 |
| ▸ | KDR | P35968 | 2/20 | 0.61 |
| ▸ | BTK | Q06187 | 2/20 | 0.61 |
| ▸ | EML4 | Q9HC35 | 2/20 | 0.61 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.61 |
| ▸ | AKT1 | P31749 | 1/20 | 0.61 |
| ▸ | GSK3B | P49841 | 1/20 | 0.61 |
| ▸ | PLK1 | P53350 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL3958863 | 0.92 | ALK (0.78) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL17703363 | 0.85 | ALK (0.84) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL1546320 | 0.85 | ALK (0.84) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL3960696 | 0.85 | ALK (0.68) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL4056789 | 0.85 | ALK (0.85) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL3954476 | 0.84 | ALK (0.57) | ALKINSRKCNH2ABL1EGFR | |
| SCHEMBL18457930 | 0.82 | ALK (0.74) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL1546327 | 0.79 | ALK (1.00) | ALKINSRKCNH2NPM1ABL1 | |
| SCHEMBL1949915 | 0.79 | ALK (0.81) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL1545644 | 0.79 | ALK (0.78) | ALKINSRKCNH2NPM1CYP3A4 |
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 4 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 | claimed |
| 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 |
| 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 |