Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | PDE4A | P27815 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6880270 | 0.87 | HDAC6 (0.50) | HDAC6KDM4ECYP1A2CYP2D6PDE4A | |
| SCHEMBL1758656 | 0.84 | HDAC8 (0.49) | HDAC6EPHX2MEN1KMT2A | |
| SCHEMBL1758576 | 0.83 | HDAC1 (0.51) | HDAC6HDAC10MEN1KMT2A | |
| SCHEMBL1758674 | 0.80 | HDAC6 (0.52) | HDAC6SMN1; SMN2HDAC10EPHX2MEN1 | |
| SCHEMBL2749026 | 0.78 | EPHX2 (0.63) | ALDH1A1EPHX2MEN1KMT2ALMNA | |
| SCHEMBL1758671 | 0.78 | ALDH1A1 (0.60) | HDAC6KDM4ECYP1A2CYP2D6PDE4A | |
| SCHEMBL1758860 | 0.77 | HDAC6 (0.58) | HDAC6KDM4ECYP1A2CYP2D6PDE4A | |
| SCHEMBL1758695 | 0.76 | MEP1B (0.46) | HDAC6ALDH1A1EPHX2MEN1KMT2A | |
| Bufexamac SCHEMBL25215 | 0.75 | KDM4E (1.00) | HDAC6KDM4ECYP1A2CYP2D6PDE4A | |
| Bufexamac SCHEMBL5076113 | 0.75 | KDM4E (1.00) | HDAC6KDM4ECYP1A2CYP2D6PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011058582-A1 | HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF FUNGAL INFECTIONS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2011-05-19 | — | — | WO | claimed |
| WO-2011058582-A1 | HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF FUNGAL INFECTIONS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2011-05-19 | — | — | WO | disclosed |