Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 7/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.33 |
| ▸ | CA1 | P00915 | 7/20 | 0.33 |
| ▸ | CA2 | P00918 | 7/20 | 0.33 |
| ▸ | CA9 | Q16790 | 6/20 | 0.32 |
| ▸ | CA12 | O43570 | 5/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7089711 | 0.91 | HDAC3 (0.41) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7089657 | 0.91 | HDAC3 (0.41) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7091743 | 0.90 | HDAC3 (0.41) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7089002 | 0.87 | HDAC1 (0.39) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7089686 | 0.86 | HDAC3 (0.39) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7089678 | 0.85 | HDAC3 (0.40) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7089754 | 0.81 | HDAC3 (0.47) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7091863 | 0.80 | HDAC3 (0.47) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7095011 | 0.79 | HDAC3 (0.43) | HDAC3HDAC6HDAC1HDAC4HDAC7 | |
| SCHEMBL7092561 | 0.78 | HDAC3 (0.44) | HDAC3HDAC6HDAC1HDAC4HDAC7 |
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-2003087127-A2 | ANTIMICROBIAL COMPOUNDS AGAINST STAPHYLOCOCCI, MYCOBACTERIA, AND OTHER INFECTIOUS AGENTS | EXEGENICS INC. (US) | 2003-10-23 | — | — | WO | disclosed |