Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3026031 | 0.86 | — | — | |
| SCHEMBL28362525 | 0.86 | HSP90AA1 (0.40) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL6685244 | 0.78 | HDAC3 (0.37) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL14835009 | 0.78 | HSP90AA1 (0.34) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL4412197 | 0.78 | CYP2D6 (0.43) | CYP3A4CYP2C9CYP2C19HRH3CYP2D6 | |
| SCHEMBL12441745 | 0.78 | HSP90AA1 (0.34) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL7718583 | 0.78 | HSP90AA1 (0.34) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL6287667 | 0.78 | CYP2A6 (0.47) | HSP90AA1HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL6685246 | 0.78 | POLB (0.40) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL293167 | 0.78 | HSP90AA1 (0.34) | HSP90AA1CYP1A2HDAC3HDAC1HDAC2 |
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-2002087587-A2 | 4-AMINOSULFONYLQUINAZOLINES AND -QUINOLINES AS TYROSINE KINASE INHIBITORS | CELLTECH R & D LIMITED (GB) | 2002-11-07 | — | — | WO | disclosed |