Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 5/20 | 0.48 |
| ▸ | EGFR | P00533 | 7/20 | 0.47 |
| ▸ | BTK | Q06187 | 5/20 | 0.47 |
| ▸ | GSK3B | P49841 | 6/20 | 0.47 |
| ▸ | GSK3A | P49840 | 4/20 | 0.47 |
| ▸ | ITK | Q08881 | 4/20 | 0.47 |
| ▸ | JAK3 | P52333 | 3/20 | 0.47 |
| ▸ | IGF1R | P08069 | 2/20 | 0.47 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.47 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | INSR | P06213 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27617470 | 0.86 | SYK (0.47) | CYP1A2AURKAEGFRBTKITK | |
| SCHEMBL27636775 | 0.86 | GSK3B (0.47) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4775386 | 0.81 | AURKA (0.49) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4772172 | 0.78 | GSK3B (0.51) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4764831 | 0.77 | EGFR (0.51) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4773983 | 0.77 | GSK3B (0.45) | CYP1A2AURKAEGFRBTKGSK3B | |
| SCHEMBL4775316 | 0.77 | JAK2 (0.46) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4769925 | 0.75 | AURKA (0.48) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4773873 | 0.75 | MAPK8 (0.51) | AURKAEGFRBTKGSK3BGSK3A | |
| SCHEMBL4774864 | 0.74 | CHEK1 (0.50) | CYP1A2AURKAEGFRBTKGSK3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100420687-C | Pyrido [2, 3-D ] pyrimidine derivatives as selective KDR and FGFR inhibitors | HOFFMANN LA ROCHE (CH) | 2008-09-24 | — | — | CN | claimed |
| CN-1729189-A | Pyrido [2, 3-D ] pyrimidine derivatives as selective KDR and FGFR inhibitors | HOFFMANN LA ROCHE (CH) | 2006-02-01 | — | — | CN | claimed |
| CN-100420687-C | Pyrido [2, 3-D ] pyrimidine derivatives as selective KDR and FGFR inhibitors | HOFFMANN LA ROCHE (CH) | 2008-09-24 | — | — | CN | disclosed |
| CN-1729189-A | Pyrido [2, 3-D ] pyrimidine derivatives as selective KDR and FGFR inhibitors | HOFFMANN LA ROCHE (CH) | 2006-02-01 | — | — | CN | disclosed |