Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.64 |
| ▸ | ERBB2 | P04626 | 14/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.60 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.60 |
| ▸ | HDAC7 | Q8WUI4 | 6/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.60 |
| ▸ | HDAC10 | Q969S8 | 6/20 | 0.60 |
| ▸ | HDAC11 | Q96DB2 | 6/20 | 0.60 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.60 |
| ▸ | HDAC5 | Q9UQL6 | 6/20 | 0.60 |
| ▸ | ABL1 | P00519 | 7/20 | 0.60 |
| ▸ | INSR | P06213 | 7/20 | 0.60 |
| ▸ | PDGFRB | P09619 | 7/20 | 0.60 |
| ▸ | CDK2 | P24941 | 7/20 | 0.60 |
| ▸ | PLK1 | P53350 | 6/20 | 0.60 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16919001 | 0.89 | EGFR (0.74) | EGFRERBB2ABL1INSRPDGFRB | |
| SCHEMBL12795405 | 0.86 | EGFR (0.66) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL8210205 | 0.86 | EGFR (0.80) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL12795411 | 0.83 | EGFR (0.74) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL12795403 | 0.82 | EGFR (0.68) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL8205533 | 0.82 | HDAC3 (0.87) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL12795412 | 0.81 | EGFR (0.76) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL8213527 | 0.81 | HDAC3 (0.88) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL12795408 | 0.81 | EGFR (0.79) | EGFRERBB2HDAC1HDAC8HDAC6 | |
| SCHEMBL4868211 | 0.80 | EGFR (0.83) | EGFRERBB2HDAC1HDAC8HDAC6 |
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-2008033749-A2 | QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY | CURIS, INC. (US) | 2008-03-20 | — | — | WO | disclosed |