Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.68 |
| ▸ | BTK | Q06187 | 12/20 | 0.68 |
| ▸ | TGM2 | P21980 | 1/20 | 0.58 |
| ▸ | ITK | Q08881 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.54 |
| ▸ | JAK3 | P52333 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28406585 | 1.00 | EGFR (0.68) | EGFRBTKTGM2ITKKCNH2 | |
| SCHEMBL28397618 | 0.89 | EGFR (0.68) | EGFRBTKTGM2ITKKCNH2 | |
| SCHEMBL30423688 | 0.89 | EGFR (0.68) | EGFRBTKTGM2ITKKCNH2 | |
| SCHEMBL30423295 | 0.88 | EGFR (0.75) | EGFRBTKTGM2ITKKCNH2 | |
| SCHEMBL28400978 | 0.88 | EGFR (0.75) | EGFRBTKTGM2ITKKCNH2 | |
| SCHEMBL30423019 | 0.85 | EGFR (0.57) | EGFRBTKTGM2ITK | |
| SCHEMBL28403032 | 0.85 | EGFR (0.57) | EGFRBTKTGM2ITK | |
| SCHEMBL2346314 | 0.81 | EGFR (1.00) | EGFRBTKITKJAK3 | |
| SCHEMBL13165513 | 0.81 | EGFR (0.86) | EGFRBTKITKJAK3 | |
| SCHEMBL691113 | 0.81 | EGFR (0.67) | EGFRBTKTGM2ITKKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111057021-B | S-triazine compound, preparation method and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | disclosed |