Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.57 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7705993 | 0.82 | ALDH1A1 (0.67) | ITGB1ITGA4ALDH1A1KDM4EPKM | |
| SCHEMBL7705184 | 0.76 | ALDH1A1 (0.51) | ITGB1ITGA4ALDH1A1KDM4EPKM | |
| SCHEMBL16064879 | 0.75 | ALDH1A1 (0.50) | ITGB1ITGA4ALDH1A1KDM4EPKM | |
| SCHEMBL21779946 | 0.74 | ALDH1A1 (0.56) | ITGB1ITGA4ALDH1A1KDM4EPKM | |
| SCHEMBL7702186 | 0.74 | CYP17A1 (0.74) | CYP17A1 | |
| SCHEMBL8812116 | 0.73 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL839161 | 0.73 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL839162 | 0.73 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL8865206 | 0.73 | ITGB1 (0.51) | ITGB1ITGA4ALDH1A1KDM4EPKM | |
| SCHEMBL8333419 | 0.73 | ALDH1A1 (0.48) | ITGB1ITGA4ALDH1A1KDM4EPKM |
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-2011058582-A1 | HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF FUNGAL INFECTIONS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2011-05-19 | — | — | WO | disclosed |