Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.55 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.55 |
| ▸ | ALK | Q9UM73 | 15/20 | 0.53 |
| ▸ | INSR | P06213 | 11/20 | 0.53 |
| ▸ | MET | P08581 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2061811 | 1.00 | KDR (0.55) | KDRAURKBALKINSRMET | |
| SCHEMBL886332 | 1.00 | KDR (0.55) | KDRAURKBALKINSRMET | |
| SCHEMBL16966216 | 0.90 | ALK (0.52) | KDRAURKBALKINSRMET | |
| SCHEMBL9949634 | 0.89 | ALK (0.62) | KDRAURKBALKINSRMET | |
| SCHEMBL9949630 | 0.89 | ALK (0.62) | KDRAURKBALKINSRMET | |
| SCHEMBL2060617 | 0.84 | ALK (0.67) | KDRAURKBALKINSRMET | |
| SCHEMBL886000 | 0.84 | ALK (0.67) | KDRAURKBALKINSRMET | |
| SCHEMBL886001 | 0.84 | ALK (0.67) | KDRAURKBALKINSRMET | |
| SCHEMBL16966160 | 0.83 | ALK (0.50) | KDRAURKBALKINSRMET | |
| SCHEMBL2061879 | 0.83 | KDR (0.56) | KDRAURKBALKINSRMET |
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-2222647-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | Cephalon, Inc. (US) | 2010-09-01 | — | — | EP | claimed |
| WO-2008051547-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | CEPHALON, INC. (US) | 2008-05-02 | — | — | WO | claimed |