Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | LIPE | Q05469 | 1/20 | 0.35 |
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 | 0.89 | HDAC6 (0.50) | EPHX2ALDH1A1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL6878609 | 0.85 | EPHX2 (0.41) | EPHX2ALDH1A1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL6879117 | 0.75 | EPHX2 (0.35) | EPHX2ALDH1A1SMN1; SMN2 | |
| SCHEMBL1758604 | 0.74 | HDAC6 (0.59) | EPHX2ALDH1A1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL6878631 | 0.74 | EPHX2 (0.42) | EPHX2ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6878384 | 0.74 | HDAC1 (0.44) | KDM4ECYP1A2CYP2D6PDE4ASMN1; SMN2 | |
| SCHEMBL8318003 | 0.71 | KDM1A (0.45) | KDM1AALDH1A1NPC1RAB9ALTA4H | |
| SCHEMBL6747214 | 0.71 | KDM1A (0.45) | KDM1AALDH1A1NPC1RAB9ALTA4H | |
| SCHEMBL8850625 | 0.70 | CYP4F2 (0.62) | ALDH1A1NPC1RAB9ALTA4HKDM4E | |
| SCHEMBL6878370 | 0.69 | MEP1B (0.40) | EPHX2ALDH1A1RAB9ASMN1; 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-2011058582-A1 | HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF FUNGAL INFECTIONS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2011-05-19 | — | — | WO | disclosed |