Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 6/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 6/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 6/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 6/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 13/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8212591 | 0.93 | EGFR (0.46) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8204254 | 0.92 | EGFR (0.54) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8204603 | 0.85 | EGFR (0.54) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8212653 | 0.85 | EGFR (0.56) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8209641 | 0.84 | EGFR (0.49) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8212590 | 0.84 | EGFR (0.52) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL16199840 | 0.81 | HDAC1 (0.50) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8212658 | 0.77 | EGFR (0.53) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8214003 | 0.75 | EGFR (0.62) | EGFRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8212204 | 0.75 | EGFR (0.65) | EGFRHDAC3HDAC4HDAC1HDAC7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009035718-A1 | TARTRATE SALTS OR COMPLEXES OF QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY | CURIS, INC. (US) | 2009-03-19 | — | — | WO | disclosed |
| WO-2008033747-A9 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS INC (MA) | 2008-07-24 | — | — | WO | disclosed |
| WO-2008033747-A2 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS, INC. (US) | 2008-03-20 | — | — | WO | disclosed |