Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.74 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.74 |
| ▸ | FBP1 | P09467 | 2/20 | 0.64 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.59 |
| ▸ | KDR | P35968 | 2/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | INSR | P06213 | 1/20 | 0.58 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.58 |
| ▸ | FLT4 | P35916 | 1/20 | 0.58 |
| ▸ | CLK1 | P49759 | 1/20 | 0.58 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.58 |
| ▸ | TEK | Q02763 | 1/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL18632967 | 0.92 | FBP1 (0.76) | EGFRERBB2FBP1ERBB4KDR | |
| SCHEMBL19027150 | 0.90 | EGFR (0.60) | EGFRERBB2FBP1KDRAURKA | |
| SCHEMBL19125553 | 0.89 | EGFR (0.63) | EGFRERBB2FBP1ERBB4KDR | |
| SCHEMBL19026591 | 0.89 | EGFR (0.59) | EGFRERBB2HDAC3HDAC4HDAC1 | |
| SCHEMBL18979196 | 0.88 | EGFR (0.69) | EGFRERBB2FBP1ERBB4KDR | |
| SCHEMBL19027000 | 0.88 | EGFR (0.58) | EGFRERBB2FBP1KDR | |
| SCHEMBL17538488 | 0.87 | EGFR (0.81) | EGFRERBB2FBP1ERBB4KDR | |
| SCHEMBL18862875 | 0.86 | EGFR (0.75) | EGFRERBB2FBP1ERBB4KDR | |
| SCHEMBL17538496 | 0.86 | EGFR (0.86) | EGFRERBB2ERBB4KDRPDGFRB | |
| SCHEMBL19026695 | 0.85 | EGFR (0.69) | EGFRERBB2FBP1KDRAURKA |
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-3181553-A1 | QUINAZOLINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Arromax Pharmatech Co., Ltd. (CN) | 2017-06-21 | — | — | EP | disclosed |