Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 14/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.54 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.52 |
| ▸ | RAF1 | P04049 | 1/20 | 0.49 |
| ▸ | BRAF | P15056 | 1/20 | 0.49 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.49 |
| ▸ | RET | P07949 | 1/20 | 0.49 |
| ▸ | KIF5B | P33176 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL642187 | 0.90 | EGFR (0.72) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5144877 | 0.83 | EGFR (0.70) | EGFRMAPTGRM1ERBB2RAF1 | |
| SCHEMBL4740851 | 0.83 | EGFR (0.66) | EGFRMAPTERBB2RAF1 | |
| Hydrochloric Acid SCHEMBL8436 | 0.81 | EGFR (0.68) | EGFRERBB2RIPK2RETKIF5B | |
| SCHEMBL8449810 | 0.81 | EGFR (0.49) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL8305108 | 0.80 | EGFR (0.48) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL8811457 | 0.79 | HDAC3 (0.43) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8364174 | 0.78 | EGFR (0.75) | EGFRERBB2ERBB4 | |
| SCHEMBL642238 | 0.78 | EGFR (0.71) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7763004 | 0.78 | ALK (0.60) | EGFRERBB2RAF1BRAFRIPK2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0824525-B1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-06-13 | — | — | EP | disclosed |
| US-5932574-A | ANTICANCER AGENT | ZENECA LIMITED (GB) | 1999-08-03 | — | — | US | disclosed |
| EP-0824525-A1 | QUINAZOLINE DERIVATIVES | ZENECA LIMITED (GB) | 1998-02-25 | — | — | EP | disclosed |
| WO-1996033977-A1 | QUINAZOLINE DERIVATIVES | ZENECA LIMITED (GB) | 1996-10-31 | — | — | WO | disclosed |