Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 6/20 | 0.49 |
| ▸ | CCNC | P24863 | 8/20 | 0.43 |
| ▸ | CDK8 | P49336 | 8/20 | 0.43 |
| ▸ | DDR1 | Q08345 | 3/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | MC5R | P33032 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.36 |
| ▸ | MC1R | Q01726 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16615358 | 0.90 | CCNC (0.46) | ALKCCNCCDK8MC4RMC5R | |
| SCHEMBL16615215 | 0.86 | ALK (0.50) | ALK | |
| SCHEMBL16615074 | 0.82 | MAPT (0.45) | — | |
| SCHEMBL16615299 | 0.82 | POLB (0.41) | ALKCCNCCDK8MC5R | |
| SCHEMBL16615268 | 0.81 | KDM4E (0.41) | CCNCCDK8 | |
| SCHEMBL16615213 | 0.75 | EPHX2 (0.43) | — | |
| SCHEMBL16615102 | 0.73 | MAPT (0.44) | — | |
| SCHEMBL17918724 | 0.70 | CCNC (0.47) | ALKCCNCCDK8 | |
| SCHEMBL16615217 | 0.69 | KCNQ2 (0.44) | — | |
| SCHEMBL17918802 | 0.68 | ALK (0.60) | ALK |
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-2015047133-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "ОТЕЧЕСТВЕННЫЕ ФАРМАЦЕВТИЧЕСКИЕ ТЕХНОЛОГИИ" | 2015-04-02 | — | — | WO | disclosed |