Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7027951 | 0.74 | HDAC1 (0.41) | HDAC1HDAC8HDAC6GSK3BDYRK1A | |
| SCHEMBL18179383 | 0.74 | ALDH1A1 (0.46) | HDAC1HDAC8HDAC6GSK3BDYRK1A | |
| SCHEMBL21376249 | 0.74 | — | — | |
| SCHEMBL21376434 | 0.73 | — | — | |
| SCHEMBL26938394 | 0.72 | DAGLA (0.33) | — | |
| SCHEMBL18214731 | 0.72 | — | — | |
| SCHEMBL7324378 | 0.72 | DAGLA (0.40) | HDAC1HDAC8HDAC6GSK3BDYRK1A | |
| SCHEMBL23193214 | 0.71 | HDAC1 (0.44) | HDAC1HDAC8HDAC6GSK3BDYRK1A | |
| SCHEMBL14845019 | 0.71 | HDAC1 (0.44) | HDAC1HDAC8HDAC6GSK3BDYRK1A | |
| SCHEMBL10094055 | 0.70 | — | — |
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-2019178248-A1 | INHIBITORS OF INTEGRIN ALPHA 2 BETA 1 AND METHODS OF USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-09-19 | — | — | WO | disclosed |