Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 3/20 | 0.49 |
| ▸ | JAK3 | P52333 | 2/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.47 |
| ▸ | AURKA | O14965 | 3/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.45 |
| ▸ | DPP4 | P27487 | 3/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | DDR1 | Q08345 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12517290 | 1.00 | BTK (0.49) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL13719359 | 0.91 | MAP4K4 (0.47) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL13719169 | 0.89 | MAP4K4 (0.45) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL12518928 | 0.89 | MAP4K4 (0.45) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL15623620 | 0.89 | BTK (0.46) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL13719171 | 0.89 | MAP4K4 (0.45) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL13822697 | 0.89 | MAP4K4 (0.45) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL12518769 | 0.85 | PIM1 (0.46) | BTKMAP4K4AURKAPDPK1AURKB | |
| SCHEMBL13876125 | 0.85 | BTK (0.48) | BTKJAK3MAP4K4AURKAPDPK1 | |
| SCHEMBL12517519 | 0.85 | MAP4K4 (0.47) | BTKJAK3MAP4K4AURKAPDPK1 |
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-2524917-A1 | FUSED PYRIDINE DERIVATIVES | Xuanzhu Pharmaco., Ltd. (CN) | 2012-11-21 | — | — | EP | disclosed |