Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.75 |
| ▸ | BTK | Q06187 | 11/20 | 0.75 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.63 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.63 |
| ▸ | ITK | Q08881 | 7/20 | 0.63 |
| ▸ | SRC | P12931 | 1/20 | 0.63 |
| ▸ | BLK | P51451 | 1/20 | 0.63 |
| ▸ | TGM2 | P21980 | 1/20 | 0.60 |
| ▸ | JAK3 | P52333 | 2/20 | 0.56 |
| ▸ | JAK2 | O60674 | 1/20 | 0.55 |
| ▸ | LYN | P07948 | 1/20 | 0.55 |
| ▸ | TEC | P42680 | 1/20 | 0.55 |
| ▸ | TXK | P42681 | 1/20 | 0.55 |
| ▸ | BMX | P51813 | 1/20 | 0.55 |
| ▸ | CD69 | Q07108 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL30423295 | 1.00 | EGFR (0.75) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL30423151 | 0.88 | EGFR (0.68) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL30423688 | 0.88 | EGFR (0.68) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL28406585 | 0.88 | EGFR (0.68) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL28397618 | 0.88 | EGFR (0.68) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL691113 | 0.88 | EGFR (0.67) | EGFRBTKKCNH2ERBB2ITK | |
| SCHEMBL6484825 | 0.88 | EGFR (0.66) | EGFRBTKERBB2ITKSRC | |
| SCHEMBL2346314 | 0.86 | EGFR (1.00) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL13165513 | 0.86 | EGFR (0.86) | EGFRBTKITKJAK3JAK2 | |
| SCHEMBL12519713 | 0.83 | EGFR (0.77) | EGFRBTKITKJAK3JAK2 |
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-111057021-B | S-triazine compound, preparation method and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | claimed |
| CN-111057021-A | S-triazine compound and its preparing method and use | 中国药科大学 | 2020-04-24 | — | — | CN | claimed |
| CN-111057021-B | S-triazine compound, preparation method and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-111057021-A | S-triazine compound and its preparing method and use | 中国药科大学 | 2020-04-24 | — | — | CN | disclosed |