Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 10/20 | 0.72 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.63 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.63 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.62 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4156343 | 0.90 | VDR (0.79) | VDRHDAC6HDAC3HDAC2 | |
| SCHEMBL4151465 | 0.85 | VDR (0.60) | VDRHDAC6HDAC3HDAC2 | |
| SCHEMBL4157673 | 0.84 | VDR (0.74) | VDRHDAC6HDAC3HDAC2CYP24A1 | |
| SCHEMBL13852413 | 0.84 | VDR (0.74) | VDRHDAC6HDAC3HDAC2CYP24A1 | |
| SCHEMBL3056435 | 0.84 | VDR (1.00) | VDRHDAC6HDAC3CYP24A1 | |
| SCHEMBL14489107 | 0.84 | VDR (1.00) | VDRHDAC6HDAC3CYP24A1 | |
| SCHEMBL12047912 | 0.84 | VDR (1.00) | VDRHDAC6HDAC3CYP24A1 | |
| SCHEMBL19988205 | 0.84 | VDR (1.00) | VDRHDAC6HDAC3CYP24A1 | |
| SCHEMBL13996344 | 0.84 | VDR (1.00) | VDRHDAC6HDAC3CYP24A1 | |
| SCHEMBL14261171 | 0.84 | VDR (0.79) | VDRHDAC6HDAC3HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009067578-A2 | NEW VITAMIN D RECEPTOR ACTIVATORS AND METHODS OF MAKING | ABBOTT LABORATORIES (US) | 2009-05-28 | — | — | WO | disclosed |