Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | MET | P08581 | 3/20 | 0.38 |
| ▸ | PDE1A | P54750 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 2/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18654782 | 0.88 | KDM4E (0.41) | ADORA2AFYNALDH1A1TP53HSD17B10 | |
| SCHEMBL14897651 | 0.82 | EGLN2 (0.45) | F11ADORA2AGRM5METPDE1A | |
| SCHEMBL18655138 | 0.82 | DYRK1A (0.51) | FYN | |
| SCHEMBL14881798 | 0.81 | F11 (0.61) | F11ADORA2AGRM5METPDE1A | |
| SCHEMBL18654657 | 0.80 | KDM4E (0.40) | ADORA2AFYNALDH1A1TP53HSD17B10 | |
| SCHEMBL14881849 | 0.80 | F11 (0.51) | F11ADORA2AMETPDE1APDE4C | |
| SCHEMBL18655239 | 0.78 | CSNK1D (0.38) | ADORA2AALDH1A1 | |
| SCHEMBL18654777 | 0.78 | FYN (0.39) | ADORA2AFYNALDH1A1TP53HSD17B10 | |
| SCHEMBL18654415 | 0.76 | TP53 (0.36) | TP53ATRCHRM4 | |
| SCHEMBL18655158 | 0.74 | TP53 (0.42) | FYNALDH1A1TP53TSHRNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |