Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 19/20 | 0.71 |
| ▸ | FBP1 | P09467 | 2/20 | 0.61 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.60 |
| ▸ | AURKA | O14965 | 1/20 | 0.60 |
| ▸ | INSR | P06213 | 1/20 | 0.60 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.60 |
| ▸ | FLT4 | P35916 | 1/20 | 0.60 |
| ▸ | KDR | P35968 | 1/20 | 0.60 |
| ▸ | CLK1 | P49759 | 1/20 | 0.60 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.60 |
| ▸ | TEK | Q02763 | 1/20 | 0.60 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL18012075 | 0.92 | FBP1 (0.72) | EGFRFBP1ERBB2AURKAINSR | |
| SCHEMBL18012076 | 0.88 | EGFR (0.79) | EGFRFBP1ERBB2AURKAINSR | |
| SCHEMBL18013033 | 0.87 | EGFR (0.69) | EGFRFBP1KDRHDAC3HDAC4 | |
| SCHEMBL19125531 | 0.85 | FBP1 (0.62) | EGFRFBP1ERBB2AURKAINSR | |
| SCHEMBL18013052 | 0.84 | KDR (0.52) | EGFRERBB2FLT4KDREPHB4 | |
| SCHEMBL3238800 | 0.83 | EGFR (0.83) | EGFRFBP1ERBB2AURKAINSR | |
| SCHEMBL4229518 | 0.82 | EGFR (0.69) | EGFRFBP1ERBB2AURKAINSR | |
| SCHEMBL18012092 | 0.82 | EGFR (0.69) | EGFRERBB2FLT4KDREPHB4 | |
| SCHEMBL18012884 | 0.82 | EGFR (0.53) | EGFRERBB2FLT4KDREPHB4 | |
| SCHEMBL18012880 | 0.82 | ERBB2 (0.55) | EGFRERBB2KDR |
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-2016123706-A1 | NOVEL FLUORINATED DERIVATIVES AS EGFR INHIBITORS USEFUL FOR TREATING CANCERS | TRILLIUM THERAPEUTICS INC. (CA) | 2016-08-11 | — | — | WO | disclosed |