Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 4/20 | 0.72 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.72 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.72 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.72 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.72 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.72 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.72 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.72 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.72 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.72 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.72 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.72 |
| ▸ | MET | P08581 | 1/20 | 0.70 |
| ▸ | NQO2 | P16083 | 1/20 | 0.70 |
| ▸ | FECH | P22830 | 1/20 | 0.70 |
| ▸ | CLK3 | P49761 | 1/20 | 0.70 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18437761 | 1.00 | PLK1 (0.72) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL18437765 | 1.00 | PLK1 (0.72) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL1123355 | 0.88 | PLK1 (0.76) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL1123171 | 0.88 | PLK1 (0.76) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL2417635 | 0.88 | PLK1 (0.76) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL2417633 | 0.88 | PLK1 (0.76) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL18437686 | 0.88 | PLK1 (0.70) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL18438100 | 0.88 | PLK1 (0.70) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL18480644 | 0.88 | PLK1 (0.69) | PLK1HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL18437778 | 0.88 | PLK1 (0.69) | PLK1HDAC4HDAC1HDAC6HDAC3 |
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-2017023912-A1 | 2,4,6-TRIALKOXYSTRYL ARYL SULFONES, SULFONAMIDES AND CARBOXAMIDES, AND METHODS OF PREPARATION AND USE | TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2017-02-09 | — | — | WO | disclosed |