Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22154645 | 0.84 | CA14 (0.36) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL1193477 | 0.83 | HDAC6 (0.35) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL25736655 | 0.77 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL25719038 | 0.76 | MAPT (0.35) | HDAC6HDAC1HDAC2CA14 | |
| SCHEMBL9537778 | 0.76 | CTSK (0.34) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL2836031 | 0.76 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL24569342 | 0.75 | HDAC6 (0.36) | HDAC6HDAC1HDAC2CA14 | |
| SCHEMBL9536343 | 0.74 | L3MBTL1 (0.45) | HDAC1HDAC2 | |
| SCHEMBL20875994 | 0.74 | CA14 (0.45) | HDAC6HDAC1HDAC2CA14CTSK | |
| SCHEMBL2733417 | 0.72 | TAAR1 (0.37) | CTSK |
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-0532693-A1 | 1,4-DIAMINO-2,3-DIHYDROXYBUTANES | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-03-24 | — | — | EP | disclosed |