Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28392074 | 0.82 | HRH3 (0.43) | HRH3GAACYP2D6NOS3NOS1 | |
| SCHEMBL31243628 | 0.79 | CYP2D6 (0.54) | HRH3GAACYP2D6HTR4 | |
| SCHEMBL29056699 | 0.78 | HRH3 (0.41) | HRH3GAACYP2D6SIGMAR1 | |
| SCHEMBL29088756 | 0.77 | SMN1; SMN2 (0.42) | HRH3CYP2D6SLC29A1LMNASIGMAR1 | |
| SCHEMBL30088871 | 0.77 | L3MBTL1 (0.46) | HRH3NOS3NOS1NOS2 | |
| SCHEMBL14641556 | 0.77 | HRH3 (0.49) | HRH3CYP2D6SLC29A1LMNA | |
| Hydrochloric Acid SCHEMBL7396009 | 0.77 | CYP2D6 (0.53) | HRH3GAACYP2D6LMNAHTR4 | |
| SCHEMBL8939921 | 0.76 | GAA (0.53) | HRH3GAALMNASIGMAR1 | |
| SCHEMBL8814790 | 0.76 | CXCR4 (0.43) | HRH3CYP2D6LMNASIGMAR1 | |
| SCHEMBL28443617 | 0.75 | HRH3 (0.43) | HRH3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111406054-A | 1, 2, 4-oxadiazole derivatives as inhibitors of histone deacetylase 6 | 奥莱松基因组股份有限公司 | 2020-07-10 | — | — | CN | disclosed |