Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 12/20 | 0.57 |
| ▸ | AR | P10275 | 5/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL3395700 | 0.88 | HDAC6 (0.61) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL3394185 | 0.85 | HDAC6 (0.60) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13786138 | 0.83 | HDAC6 (0.58) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13785970 | 0.82 | VDR (0.65) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13366805 | 0.79 | HDAC6 (0.66) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL3422595 | 0.79 | HDAC6 (0.51) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13786192 | 0.79 | VDR (0.46) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13366688 | 0.78 | VDR (0.58) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL13672905 | 0.78 | HDAC6 (0.46) | VDRARHDAC6HDAC3HDAC1 | |
| SCHEMBL2969233 | 0.78 | HDAC6 (0.66) | VDRARHDAC6HDAC3HDAC1 |
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-1511740-B1 | PHENYL-THIOPHENE TYPE VITAMIN D RECEPTOR MODULATORS | LILLY CO ELI (US) | 2009-07-08 | — | — | EP | disclosed |