Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 15/20 | 0.49 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.41 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22791318 | 0.88 | KHK (0.66) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL22791494 | 0.88 | KHK (0.66) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL25990202 | 0.86 | KHK (0.52) | KHK | |
| SCHEMBL22791426 | 0.85 | KHK (0.70) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL28702332 | 0.85 | KHK (0.70) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL29466182 | 0.85 | KHK (0.70) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL22770629 | 0.82 | KHK (0.71) | KHK | |
| SCHEMBL22770648 | 0.82 | KHK (0.70) | KHK | |
| SCHEMBL22770666 | 0.82 | KHK (0.49) | KHKFGFR3KDRFGFR1FGFR2 | |
| SCHEMBL22770658 | 0.81 | KHK (0.72) | KHKFGFR3KDRFGFR1FGFR2 |
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-2020257171-A1 | DISUBSTITUTED PYRAZOLE COMPOUNDS AS KETOHEXOKINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2020-12-24 | — | — | WO | disclosed |