Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.62 |
| ▸ | VDR | P11473 | 9/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.61 |
| ▸ | CDC25A | P30304 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3681975 | 1.00 | HDAC6 (0.62) | HDAC6HDAC3VDRHDAC2CDC25A | |
| SCHEMBL8677057 | 0.88 | HDAC6 (0.56) | HDAC6HDAC3VDRHDAC2ADORA3 | |
| SCHEMBL8677059 | 0.88 | HDAC6 (0.56) | HDAC6HDAC3VDRHDAC2ADORA3 | |
| SCHEMBL7570689 | 0.86 | VDR (0.63) | HDAC6HDAC3VDRHDAC2CDC25A | |
| SCHEMBL7570677 | 0.86 | VDR (0.63) | HDAC6HDAC3VDRHDAC2CDC25A | |
| SCHEMBL30452668 | 0.84 | VDR (0.79) | VDRADORA3SLC6A2AGTR1 | |
| SCHEMBL3679281 | 0.83 | VDR (0.83) | VDRADORA3SLC6A2AGTR1 | |
| SCHEMBL13532024 | 0.83 | HDAC6 (0.81) | HDAC6HDAC3VDRHDAC2 | |
| SCHEMBL8971029 | 0.81 | CDC25A (0.54) | HDAC6HDAC3VDRHDAC2CDC25A | |
| SCHEMBL24299437 | 0.79 | NR1I2 (0.63) | HDAC6HDAC3VDRHDAC2ADORA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0696275-B1 | VITAMIN D AMIDE DERIVATIVES | RES INST MEDICINE CHEM (US) | 1998-08-12 | — | — | EP | disclosed |
| US-5756733-A | Vitamin D amide derivatives | RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY (US) | 1998-05-26 | — | — | US | disclosed |