Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.67 |
| ▸ | HDAC3 | O15379 | 11/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 8/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 8/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 8/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 8/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 8/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 8/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 8/20 | 0.67 |
| ▸ | ERBB2 | P04626 | 7/20 | 0.67 |
| ▸ | ABL1 | P00519 | 4/20 | 0.67 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.67 |
| ▸ | CDK2 | P24941 | 4/20 | 0.67 |
| ▸ | INSR | P06213 | 2/20 | 0.67 |
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | CIT | O14578 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16199857 | 0.91 | EGFR (0.65) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8209645 | 0.91 | EGFR (0.72) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8204223 | 0.91 | EGFR (0.62) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8212469 | 0.91 | EGFR (0.62) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL10118517 | 0.90 | HDAC3 (0.76) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL16199858 | 0.86 | EGFR (0.57) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL10118507 | 0.84 | EGFR (0.75) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8204603 | 0.84 | EGFR (0.54) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8212204 | 0.83 | EGFR (0.65) | EGFRHDAC3HDAC1HDAC4HDAC7 | |
| SCHEMBL8212590 | 0.83 | EGFR (0.52) | EGFRHDAC3HDAC1HDAC4HDAC7 |
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 |