Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.46 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.46 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.46 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.45 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.45 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 2/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | GPX4 | P36969 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8887885 | 0.82 | CYP1A2 (0.50) | MAPK14MAPK11MAPK13RAF1MAPK12 | |
| SCHEMBL8888361 | 0.80 | CYP1A2 (0.50) | PDGFRBCDK8NTRK3NTRK2AURKB | |
| SCHEMBL8890194 | 0.80 | CYP1A2 (0.50) | MAPK14MAPK11MAPK13RAF1MAPK12 | |
| SCHEMBL8887621 | 0.80 | CYP1A2 (0.50) | MAPK14CYP1A2TP53MAPTSMN1; SMN2 | |
| SCHEMBL1769732 | 0.79 | JAK2 (0.62) | JAK2NTRK1RETPDGFRBCDK8 | |
| SCHEMBL8889484 | 0.77 | CYP1A2 (0.53) | MAPK14MAPK11MAPK13RAF1MAPK12 | |
| SCHEMBL8889663 | 0.77 | CYP1A2 (0.47) | CYP1A2TP53MAPTSMN1; SMN2AKR1B1 | |
| SCHEMBL8886941 | 0.77 | NR1H2 (0.49) | MAPK14MAPK11MAPK13RAF1MAPK12 | |
| SCHEMBL8889786 | 0.75 | CYP1A2 (0.45) | PDGFRBCDK8NTRK3NTRK2AURKB | |
| SCHEMBL8888926 | 0.75 | KMT2A (0.57) | CYP1A2TP53MAPTSMN1; SMN2ALDH1A1 |
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-1997001551-A1 | PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-01-16 | — | — | WO | disclosed |