Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT1 | P04628 | 6/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.43 |
| ▸ | CLK2 | P49760 | 6/20 | 0.43 |
| ▸ | CLK3 | P49761 | 6/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.42 |
| ▸ | ITK | Q08881 | 2/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17801042 | 0.81 | CHEK2 (0.39) | PDPK1 | |
| SCHEMBL17801079 | 0.79 | PDPK1 (0.49) | WNT1PDPK1CLK2CLK3DYRK1A | |
| SCHEMBL2865036 | 0.74 | PDPK1 (0.65) | PDPK1AAK1ITK | |
| SCHEMBL17801054 | 0.73 | CPT1A (0.55) | MAP3K5 | |
| SCHEMBL17801010 | 0.73 | HCRTR2 (0.44) | — | |
| SCHEMBL17801046 | 0.72 | CPT1A (0.45) | PDPK1MAP3K5 | |
| SCHEMBL5381303 | 0.71 | AAK1 (0.52) | WNT1PDPK1CLK2CLK3DYRK1A | |
| SCHEMBL5377953 | 0.70 | CLK2 (0.53) | WNT1PDPK1CLK2CLK3DYRK1A | |
| SCHEMBL4917155 | 0.70 | NPC1 (0.51) | — | |
| SCHEMBL6786829 | 0.70 | ROCK1 (0.62) | — |
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-2016089977-A1 | SUBSTITUTED INDAZOLE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH | CELGENE CORPORATION (US) | 2016-06-09 | — | — | WO | disclosed |