Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 8/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | DYRK4 | Q9NR20 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18487332 | 0.84 | DYRK1A (0.45) | ACHEDYRK1AMAOADYRK3CLK1 | |
| SCHEMBL18487541 | 0.84 | ACHE (0.62) | ACHEDYRK1AMAOADYRK3CLK1 | |
| SCHEMBL20438859 | 0.82 | KDM4E (0.44) | ACHEDYRK1AMAOADYRK3CLK1 | |
| SCHEMBL20800900 | 0.80 | ACHE (0.57) | ACHEDYRK1AMAOADYRK3CLK1 | |
| SCHEMBL23150420 | 0.72 | DYRK1A (0.73) | ACHEDYRK1AMAOAHASPINHTR2A | |
| SCHEMBL2794137 | 0.71 | TNFRSF1A (0.46) | DYRK1AL3MBTL1HCRTR1ATMKDM4E | |
| SCHEMBL18487312 | 0.71 | DYRK1A (0.48) | ACHEDYRK1AMAOADYRK3CLK1 | |
| SCHEMBL20434642 | 0.70 | MAPT (0.41) | ACHEDYRK1AL3MBTL1HCRTR1ATM | |
| SCHEMBL2792990 | 0.70 | TNFRSF1A (0.43) | DYRK1AL3MBTL1HCRTR1ATMKDM4E | |
| SCHEMBL791878 | 0.69 | MAOB (0.54) | MAOATSHR |
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-2017023916-A1 | SMALL MOLECULE ANDROGEN RECEPTOR INHIBITORS AND METHODS OF USE THEREOF | GEORGETOWN UNIVERSITY (US) | 2017-02-09 | — | — | WO | disclosed |