Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 9/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 9/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 9/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 9/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 9/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 9/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.36 |
| ▸ | RORA | P35398 | 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 | |
|---|---|---|---|---|
| SCHEMBL7024108 | 0.80 | DYRK1A (0.40) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL8078513 | 0.79 | KIF11 (0.52) | S1PR1NOS3NOS2 | |
| SCHEMBL17392954 | 0.78 | CTSS (0.39) | GRM2NOS3NOS2 | |
| SCHEMBL2296580 | 0.76 | RAPGEF4 (0.35) | CYP3A4 | |
| SCHEMBL16055751 | 0.76 | NPBWR1 (0.41) | CYP3A4 | |
| SCHEMBL5897973 | 0.75 | PTPN5 (0.41) | — | |
| SCHEMBL28007985 | 0.75 | SORT1 (0.38) | NOS3NOS2DYRK1ASORT1 | |
| SCHEMBL29497390 | 0.74 | NOS3 (0.57) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL1312951 | 0.74 | NOS3 (0.57) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL14258707 | 0.74 | PSEN1 (0.59) | PSEN1PSEN2APH1BNCSTNAPH1A |
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-104394869-A | Substituted bicyclic aza-heterocycles and analogues as sirtuin modulators | GLAXOSMITHKLINE LLC | 2015-03-04 | — | — | CN | disclosed |