Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 7/20 | 0.41 |
| ▸ | SYK | P43405 | 7/20 | 0.40 |
| ▸ | CD63 | P08962 | 3/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13531794 | 0.88 | AURKA (0.41) | AURKASYKCD63BTK | |
| SCHEMBL13531807 | 0.80 | SYK (0.39) | AURKASYKCD63BTK | |
| SCHEMBL1069035 | 0.78 | AURKA (0.50) | AURKASYKCD63 | |
| SCHEMBL12637969 | 0.78 | AURKA (0.50) | AURKASYKCD63 | |
| SCHEMBL14878010 | 0.77 | BTK (0.38) | AURKASYKBTKEPHB4 | |
| SCHEMBL2996265 | 0.74 | TGFBR1 (0.40) | AURKASYKCD63BTKTGFBR1 | |
| SCHEMBL13531793 | 0.73 | BTK (0.46) | AURKASYKBTKEPHB4 | |
| SCHEMBL1068707 | 0.73 | SYK (0.53) | AURKASYKCD63BTK | |
| SCHEMBL1542044 | 0.72 | BTK (0.48) | AURKASYKBTK | |
| SCHEMBL1068193 | 0.71 | BTK (0.59) | SYKCD63BTK |
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 |
|---|---|---|---|---|---|---|---|
| US-8426409-B2 | 7-tert-Butyl-3-(3-{8-[4-(morpholine-4-carbonyl)-phenylamino]-imidazo[1,2-a]pyrazin-6-yl}-phenyl)-3H-quinazolin-4-one; arthritis; inhibit Btk | ROCHE PALO ALTO LLC (US) | 2013-04-23 | — | — | US | disclosed |