Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2941098 | 0.85 | HDAC8 (0.34) | HDAC8 | |
| SCHEMBL4037642 | 0.85 | HDAC8 (0.34) | HDAC8 | |
| SCHEMBL1802720 | 0.84 | HDAC8 (0.40) | HDAC8KDM4EALDH1A1MAPTTDP1 | |
| SCHEMBL3927548 | 0.84 | HDAC8 (0.40) | HDAC8KDM4EALDH1A1MAPTTDP1 | |
| SCHEMBL4033021 | 0.78 | HDAC8 (0.34) | HDAC8ALDH1A1MAPT | |
| SCHEMBL2939814 | 0.77 | HDAC8 (0.36) | HDAC8 | |
| Hydrochloric Acid SCHEMBL1800200 | 0.76 | HDAC8 (0.35) | HDAC8 | |
| SCHEMBL4039483 | 0.73 | CCR5 (0.34) | HDAC8 | |
| SCHEMBL4035139 | 0.71 | GAA (0.43) | KDM4EALDH1A1MAPT | |
| SCHEMBL1801346 | 0.71 | HSD11B1 (0.43) | KDM4EALDH1A1 |
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-1730144-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2009-06-10 | — | — | EP | disclosed |