Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1758655 | 0.75 | CNR2 (0.59) | CNR2KMT2AEPHX2GAANPC1 | |
| SCHEMBL6879978 | 0.64 | CNR2 (0.45) | HDAC6CNR2HDAC8EPHX2GAA | |
| SCHEMBL1758648 | 0.62 | CNR2 (0.60) | CNR2KMT2AEPHX2GAANPC1 | |
| SCHEMBL1758672 | 0.60 | HDAC1 (0.41) | HDAC6HDAC8 | |
| SCHEMBL6384681 | 0.56 | ALDH1A1 (0.61) | EPHX2P2RX7 | |
| SCHEMBL4907174 | 0.56 | MEN1 (0.34) | KMT2AGAAPOLBRAB9A | |
| SCHEMBL31532570 | 0.55 | IDH1 (0.32) | — | |
| SCHEMBL22570461 | 0.55 | ALDH1A1 (0.68) | GLAKMT2AEPHX2P2RX7 | |
| SCHEMBL23547606 | 0.55 | NPSR1 (0.44) | KMT2AHPGDNPC1RAB9A | |
| SCHEMBL24917625 | 0.55 | HDAC3 (0.35) | HDAC6HDAC8GAANPC1RAB9A |
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 |