Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 16/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 15/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 15/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 15/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 14/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 14/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 14/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 13/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 13/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 13/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 13/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | NR0B1 | P51843 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7902116 | 0.80 | SIGMAR1 (0.40) | HDAC1CYP3A4KCNH2 | |
| SCHEMBL810778 | 0.73 | NAMPT (0.65) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL5623342 | 0.71 | QPCT (0.43) | — | |
| SCHEMBL504490 | 0.71 | HDAC6 (0.53) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL504491 | 0.71 | HDAC6 (0.53) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL137348 | 0.69 | HDAC4 (0.85) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL6665592 | 0.69 | HDAC4 (0.85) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL1065393 | 0.69 | HDAC4 (0.85) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL6669511 | 0.69 | HDAC4 (0.85) | HDAC8HDAC2HDAC6HDAC1HDAC4 | |
| SCHEMBL9550361 | 0.68 | L3MBTL1 (0.61) | HDAC8HDAC2HDAC6HDAC1HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6346541-B1 | ANTITUMOR AND ANTICARCINOGENIC AGENTS FOR BREAST, LUNG, AND SKIN CANCER | LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) | 2002-02-12 | — | — | US | disclosed |