Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 3/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 7/20 | 0.39 |
| ▸ | CTSC | P53634 | 7/20 | 0.39 |
| ▸ | BTK | Q06187 | 4/20 | 0.38 |
| ▸ | BCL6 | P41182 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28085704 | 0.83 | CCNA2 (0.38) | EGFR | |
| SCHEMBL1025353 | 0.81 | BCL6 (0.41) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL1024220 | 0.79 | ALK (0.40) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL1026332 | 0.79 | BCL6 (0.41) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL1027094 | 0.77 | BCL6 (0.43) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL28085696 | 0.75 | JAK3 (0.39) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL1025568 | 0.75 | CTSC (0.42) | JAK3EGFRCTSCBTK | |
| SCHEMBL13669984 | 0.74 | CTSC (0.39) | JAK3JAK2JAK1EGFRCTSC | |
| SCHEMBL1025065 | 0.74 | PIN1 (0.43) | EGFR | |
| SCHEMBL1026960 | 0.73 | EGFR (0.37) | JAK3JAK2JAK1EGFRCTSC |
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-105801603-A | ALK inhibitor with macrocyclic structure and preparation method thereof | 成都倍特药业有限公司 | 2016-07-27 | — | — | CN | disclosed |