Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.57 |
| ▸ | LCK | P06239 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24061516 | 0.90 | BTK (0.57) | BTKLCK | |
| SCHEMBL24061705 | 0.89 | BTK (0.58) | BTKLCKKCNH2 | |
| SCHEMBL24061690 | 0.88 | BTK (0.51) | BTKLCK | |
| SCHEMBL17645933 | 0.87 | BTK (0.58) | BTKLCKKCNH2 | |
| SCHEMBL24061657 | 0.86 | BTK (0.57) | BTKLCK | |
| SCHEMBL17646036 | 0.86 | BTK (0.59) | BTKLCK | |
| SCHEMBL17645888 | 0.86 | BTK (0.73) | BTKLCK | |
| SCHEMBL30950575 | 0.86 | BTK (0.59) | BTKLCK | |
| SCHEMBL17645701 | 0.86 | BTK (0.59) | BTKLCK | |
| SCHEMBL17645748 | 0.85 | BTK (0.53) | BTKLCKKCNH2 |
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-3204382-B1 | HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2021-12-01 | — | — | EP | disclosed |