Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8562622 | 0.77 | — | — | |
| SCHEMBL969859 | 0.76 | TSHR (0.33) | HPGDTSHRHTTSMN1; SMN2 | |
| SCHEMBL7046884 | 0.74 | — | — | |
| SCHEMBL10998680 | 0.72 | — | — | |
| SCHEMBL8546188 | 0.72 | ALDH1A1 (0.31) | HPGDSMN1; SMN2 | |
| SCHEMBL3939619 | 0.70 | — | — | |
| SCHEMBL19200687 | 0.68 | HDAC8 (0.35) | HDAC2HDAC8HDAC6HPGDTSHR | |
| SCHEMBL11999050 | 0.68 | — | — | |
| SCHEMBL10512179 | 0.68 | TP53 (0.31) | — | |
| SCHEMBL4912716 | 0.68 | TSHR (0.40) | HPGDTSHRSMN1; SMN2 |
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-2011063773-A2 | CRYSTALLINE AND AMORPHOUS FORMS OF ALMOREXANT AND A METHOD OF THEIR PREPARATION | ZENTIVA, K.S. (CZ) | 2011-06-03 | — | — | WO | disclosed |