Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 6/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 5/20 | 0.34 |
| ▸ | ACACB | O00763 | 3/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.33 |
| ▸ | HRH1 | P35367 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14912471 | 0.86 | BTK (0.41) | BTKACACB | |
| SCHEMBL10256055 | 0.85 | PIK3CA (0.42) | BTK | |
| SCHEMBL30512276 | 0.85 | PIK3CA (0.42) | BTK | |
| SCHEMBL29742153 | 0.85 | BTK (0.37) | BTKLMNASRC | |
| SCHEMBL1726359 | 0.83 | BTK (0.47) | BTKACACB | |
| SCHEMBL29741802 | 0.83 | BTK (0.47) | BTKACACB | |
| SCHEMBL29741933 | 0.82 | BTK (0.42) | BTK | |
| SCHEMBL14930421 | 0.81 | BTK (0.41) | BTKACACB | |
| SCHEMBL14912769 | 0.81 | BTK (0.39) | BTK | |
| SCHEMBL10255875 | 0.79 | BTK (0.41) | BTK |
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 |
|---|---|---|---|---|---|---|---|
| EP-4050012-A1 | PYRIDONE BORONATES FOR THE PREPARATION OF INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2022-08-31 | — | — | EP | disclosed |
| EP-4019508-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2022-06-29 | — | — | EP | disclosed |