Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 3/20 | 0.42 |
| ▸ | RARB | P10826 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | RARG | P13631 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 2/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | BCL2 | P10415 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1024642 | 0.84 | BACE1 (0.43) | BACE1 | |
| SCHEMBL1471407 | 0.84 | BACE1 (0.43) | BACE1 | |
| SCHEMBL11699116 | 0.80 | BACE1 (0.48) | RXRARARBBACE1RARGSRD5A2 | |
| SCHEMBL11699129 | 0.80 | BACE1 (0.48) | RXRARARBBACE1RARGSRD5A2 | |
| SCHEMBL3556722 | 0.77 | ERN1 (0.53) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL29950910 | 0.77 | ERN1 (0.53) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL6240189 | 0.76 | BACE1 (0.55) | RXRARARBBACE1RARGRXRB | |
| SCHEMBL28583890 | 0.76 | TSHR (0.45) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL7935155 | 0.74 | ALDH1A1 (0.46) | BACE1SRD5A2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL7929273 | 0.74 | ALDH1A1 (0.46) | BACE1SRD5A2MAPTSMN1; SMN2ALDH1A1 |
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-2573069-A2 | Inhibitors of histone deacetylase and prodrugs thereof | MethylGene Inc. (CA) | 2013-03-27 | — | — | EP | disclosed |
| EP-1233958-B1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC (CA) | 2011-06-29 | — | — | EP | disclosed |