Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 13/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 13/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 13/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 13/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 13/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 13/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 13/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 13/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 13/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 13/20 | 0.40 |
| ▸ | EGFR | P00533 | 12/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 11/20 | 0.40 |
| ▸ | KDR | P35968 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19006877 | 0.87 | EGFR (0.40) | EGFRKDR | |
| SCHEMBL19006648 | 0.82 | EGFR (0.47) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL19006647 | 0.72 | EGFR (0.38) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL19006966 | 0.71 | EGFR (0.53) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL19006906 | 0.70 | L3MBTL4 (0.36) | EGFRKDR | |
| SCHEMBL19006876 | 0.66 | HDAC3 (0.38) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL17520334 | 0.64 | EGFR (0.87) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL13882704 | 0.64 | EGFR (0.87) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL19006874 | 0.64 | EGFR (0.49) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL19736801 | 0.61 | HDAC1 (0.57) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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-3181554-A1 | QUINAZOLINE DERIVATIVE | CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang) Co., Ltd. (CN) | 2017-06-21 | — | — | EP | disclosed |