Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 8/20 | 0.62 |
| ▸ | EGFR | P00533 | 10/20 | 0.61 |
| ▸ | JAK3 | P52333 | 2/20 | 0.56 |
| ▸ | ITK | Q08881 | 3/20 | 0.54 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL22604617 | 0.92 | EGFR (0.59) | BTKEGFRJAK3ITKMAP3K7 | |
| SCHEMBL93523 | 0.85 | MAP3K7 (0.74) | BTKEGFRJAK3MAP3K7MAP2K1 | |
| SCHEMBL29352639 | 0.85 | MAP3K7 (0.74) | BTKEGFRJAK3MAP3K7MAP2K1 | |
| SCHEMBL30854787 | 0.85 | MAP3K7 (0.74) | BTKEGFRJAK3MAP3K7MAP2K1 | |
| SCHEMBL13165510 | 0.85 | BTK (0.69) | BTKEGFRJAK3ITK | |
| SCHEMBL28080977 | 0.78 | BTK (0.88) | BTKEGFRJAK3ITK | |
| SCHEMBL27831797 | 0.76 | EGFR (0.84) | BTKEGFRJAK3ITK | |
| SCHEMBL28059266 | 0.76 | EGFR (0.77) | BTKEGFRITK | |
| SCHEMBL10127876 | 0.75 | JAK3 (0.80) | BTKEGFRJAK3ITK | |
| SCHEMBL13169901 | 0.75 | EGFR (0.58) | BTKEGFRJAK3ITK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020219963-A1 | METHODS AND COMPOSITIONS FOR TREATING CHRONIC INFLAMMATORY INJURY, METAPLASIA, DYSPLASIA AND CANCERS OF EPITHELIAL TISSUES | UNIVERSITY OF HOUSTON SYSTEM (US) | 2020-10-29 | — | — | WO | disclosed |