Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 19/20 | 0.56 |
| ▸ | LCK | P06239 | 2/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17645713 | 0.87 | BTK (0.59) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17646065 | 0.82 | BTK (0.65) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17645938 | 0.82 | BTK (0.81) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17645654 | 0.82 | BTK (0.64) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17646017 | 0.78 | BTK (0.56) | BTKLCKCCNT1CDK9 | |
| SCHEMBL24061622 | 0.74 | BTK (0.54) | BTKLCK | |
| SCHEMBL24061614 | 0.73 | BTK (0.54) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17645648 | 0.72 | BTK (0.54) | BTKLCKCCNT1CDK9 | |
| SCHEMBL17645970 | 0.72 | BTK (0.64) | BTKLCK | |
| SCHEMBL17645784 | 0.71 | BTK (0.62) | BTKLCK |
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-3204382-A1 | HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF | Merck Patent GmbH (DE) | 2017-08-16 | — | — | EP | disclosed |
| WO-2016057500-A1 | HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2016-04-14 | — | — | WO | disclosed |