Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389821 | 0.89 | HDAC6 (0.46) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL13786148 | 0.84 | HDAC6 (0.42) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL3389811 | 0.84 | HDAC6 (0.46) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL13366712 | 0.82 | PPARG (0.37) | HDAC6HDAC3HDAC1VDRKDM4E | |
| SCHEMBL3392979 | 0.81 | HDAC6 (0.54) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL3388902 | 0.81 | HDAC6 (0.46) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL13786313 | 0.81 | HDAC6 (0.46) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL4421979 | 0.76 | HDAC6 (0.46) | HDAC6HDAC3HDAC1VDRAR | |
| SCHEMBL3391254 | 0.74 | HDAC6 (0.55) | HDAC6HDAC3HDAC1VDRAR | |
| Acetic Acid Methyl Ester SCHEMBL3389823 | 0.74 | HDAC6 (0.47) | HDAC6HDAC3HDAC1VDRAR |
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 |