Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 16/20 | 0.63 |
| ▸ | CD69 | Q07108 | 2/20 | 0.49 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HRH2 | P25021 | 1/20 | 0.47 |
| ▸ | CDK7 | P50613 | 1/20 | 0.47 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.47 |
| ▸ | MAP3K19 | Q56UN5 | 1/20 | 0.47 |
| ▸ | CDKL2 | Q92772 | 1/20 | 0.47 |
| ▸ | RIOK1 | Q9BRS2 | 1/20 | 0.47 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.47 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16794488 | 1.00 | BTK (0.63) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794487 | 1.00 | BTK (0.63) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL18170391 | 0.92 | BTK (0.70) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL29676669 | 0.91 | BTK (0.68) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794360 | 0.91 | BTK (0.68) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794456 | 0.91 | BTK (0.68) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794458 | 0.91 | BTK (0.68) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794059 | 0.91 | BTK (0.69) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794252 | 0.90 | BTK (0.70) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL29676473 | 0.89 | BTK (0.65) | BTKCD69JAK2CYP3A4HRH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3357921-A2 | BIARYL COMPOUNDS USEFUL FOR THE TREATMENT OF HUMAN DISEASES IN ONCOLOGY, NEUROLOGY AND IMMUNOLOGY | Sunesis Pharmaceuticals, Inc. (US) | 2018-08-08 | — | — | EP | disclosed |