Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 17/20 | 0.51 |
| ▸ | INSR | P06213 | 9/20 | 0.50 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | PAK4 | O96013 | 1/20 | 0.48 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.48 |
| ▸ | MARK3 | P27448 | 1/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.48 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.48 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.48 |
| ▸ | CLK2 | P49760 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.48 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.48 |
| ▸ | NEK4 | P51957 | 1/20 | 0.48 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.48 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.48 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13076789 | 0.85 | MAP3K7 (0.67) | MAP3K7IRAK4KDM4EMEN1TSHR | |
| SCHEMBL3795349 | 0.83 | ITK (0.59) | ITKINSRMAP3K7PDPK1MAP4K4 | |
| SCHEMBL19236089 | 0.82 | ITK (0.53) | ITKINSRMAP3K7PDPK1MAP4K4 | |
| SCHEMBL13076790 | 0.81 | ITK (0.49) | ITKINSRMAP3K7PDPK1MAP4K4 | |
| SCHEMBL13076210 | 0.80 | KDM4E (0.51) | MAP3K7CLK2CLK4IRAK4KDM4E | |
| SCHEMBL3800341 | 0.79 | ITK (0.48) | ITKINSRMAP3K7PDPK1MAP4K4 | |
| SCHEMBL3802008 | 0.79 | ITK (0.58) | ITKINSRMAP3K7PDPK1MAP4K4 | |
| SCHEMBL3796215 | 0.77 | ITK (0.54) | ITKINSRPDPK1MAP4K4PAK4 | |
| SCHEMBL3808813 | 0.76 | ITK (0.59) | ITKINSRMAP3K7MAP4K4PHKG2 | |
| SCHEMBL3798557 | 0.75 | KDM4E (0.52) | ITKINSRMAP3K7CLK2CLK4 |
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-2010126922-A1 | BENZIMIDAZOLECARBOXAMIDES AS INHIBITORS OF FAK | GLAXOSMITHKLINE LLC (US) | 2010-11-04 | — | — | WO | disclosed |