Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 9/20 | 0.50 |
| ▸ | EGFR | P00533 | 9/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.44 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.43 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | INSR | P06213 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16199839 | 0.92 | HDAC1 (0.54) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL8212590 | 0.87 | EGFR (0.52) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL8209641 | 0.86 | EGFR (0.49) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL16199858 | 0.85 | EGFR (0.57) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL10118519 | 0.84 | EGFR (0.64) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL8212097 | 0.81 | EGFR (0.43) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL10118518 | 0.78 | EGFR (0.69) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL8212204 | 0.78 | EGFR (0.65) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL8214003 | 0.77 | EGFR (0.62) | HDAC1EGFRHDAC3HDAC2HDAC4 | |
| SCHEMBL10118523 | 0.77 | EGFR (0.65) | HDAC1EGFRHDAC3HDAC2HDAC4 |
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-2190287-B1 | TARTRATE SALTS OR COMPLEXES OF QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY | CURIS INC (US) | 2014-10-29 | — | — | EP | disclosed |