Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 7/20 | 0.54 |
| ▸ | TTK | P33981 | 13/20 | 0.54 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.54 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.54 |
| ▸ | IGF1R | P08069 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29017308 | 0.90 | JAK3 (0.53) | PTK2TTKPIK3CBMAPK8IGF1R | |
| SCHEMBL12429374 | 0.82 | PTK2 (0.69) | PTK2TTKMAPK8IGF1R | |
| SCHEMBL29017290 | 0.79 | TTK (0.65) | PTK2TTKPIK3CBMAPK8IGF1R | |
| SCHEMBL18696331 | 0.77 | TTK (0.63) | PTK2TTKIGF1R | |
| SCHEMBL29017299 | 0.76 | CCND3 (0.52) | PTK2 | |
| SCHEMBL18696334 | 0.75 | IGF1R (0.57) | PTK2TTKPIK3CBMAPK8IGF1R | |
| SCHEMBL18696330 | 0.72 | ALK (0.65) | PTK2TTKIGF1R | |
| SCHEMBL12429379 | 0.72 | PTK2 (0.85) | PTK2TTKPIK3CBMAPK8IGF1R | |
| SCHEMBL17731732 | 0.70 | TTK (1.00) | PTK2TTKPIK3CBMAPK8IGF1R | |
| SCHEMBL4383739 | 0.70 | JAK2 (0.60) | PTK2TTK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116239597-A | Pyrimidine pyrrole derivative and medicinal composition and application thereof | 中国科学院上海药物研究所 | 2023-06-09 | — | — | CN | claimed |
| CN-116239597-A | Pyrimidine pyrrole derivative and medicinal composition and application thereof | 中国科学院上海药物研究所 | 2023-06-09 | — | — | CN | disclosed |