Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 17/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | TEC | P42680 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL16075279 | 0.93 | BTK (0.66) | BTKEGFRTEC | |
| SCHEMBL19909712 | 0.89 | ALDH1A1 (0.65) | BTKALDH1A1HTTNPSR1ALOX5 | |
| SCHEMBL19909686 | 0.88 | ALDH1A1 (0.63) | BTKALDH1A1HTTNPSR1ALOX5 | |
| SCHEMBL16075268 | 0.84 | BTK (0.72) | BTKEGFRTEC | |
| SCHEMBL16075278 | 0.84 | BTK (0.73) | BTK | |
| SCHEMBL16075271 | 0.83 | BTK (0.70) | BTKEGFRTEC | |
| SCHEMBL16075293 | 0.83 | BTK (0.68) | BTKEGFRTEC | |
| SCHEMBL16075287 | 0.82 | BTK (0.56) | BTKALDH1A1HTTNPSR1EGFR | |
| SCHEMBL16597823 | 0.81 | BTK (0.55) | BTKALDH1A1HTTNPSR1EGFR | |
| SCHEMBL20007850 | 0.81 | BTK (0.84) | BTKEGFRTEC |
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-2970163-B1 | 5-THIAZOLECARBOXAMIDE DERVATIVES AND THEIR USE AS BTK INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2018-02-28 | — | — | EP | disclosed |