Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15375290 | 0.88 | HDAC1 (0.39) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| Octane SCHEMBL1164389 | 0.85 | HDAC1 (0.39) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| SCHEMBL275321 | 0.81 | HDAC3 (0.36) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| SCHEMBL5915087 | 0.81 | HDAC3 (0.36) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| SCHEMBL14889184 | 0.80 | ALDH1A1 (0.36) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| Acetaldehyde SCHEMBL591968 | 0.77 | HTT (0.35) | HDAC1HDAC11HDAC8HDAC6TSHR | |
| Thiophene SCHEMBL2762416 | 0.75 | HDAC3 (0.33) | HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL5457905 | 0.74 | TSHR (0.46) | HDAC11TSHR | |
| SCHEMBL15530135 | 0.73 | TP53 (0.34) | — | |
| SCHEMBL371289 | 0.69 | ALDH1A1 (0.31) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2662379-A1 | Recycling of organotin compounds | Universiteit Antwerpen (BE) | 2013-11-13 | — | — | EP | disclosed |