Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 20/20 | 0.64 |
| ▸ | HSP90AB1 | P08238 | 5/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.55 |
| ▸ | CDC37 | Q16543 | 1/20 | 0.54 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8151991 | 0.88 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL8152895 | 0.87 | HSP90AA1 (0.84) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL8158943 | 0.85 | HSP90AA1 (0.85) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL8204526 | 0.84 | HSP90AA1 (0.87) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL8153203 | 0.84 | HSP90AA1 (0.87) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL4480998 | 0.78 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL4900367 | 0.78 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL8146229 | 0.74 | HSP90AA1 (0.94) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL4130807 | 0.72 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1CDC37HSP90B1 | |
| SCHEMBL8146240 | 0.71 | HSP90AA1 (0.98) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |