Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | SLC6A9 | P48067 | 9/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.39 |
| ▸ | F12 | P00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL4067655 | 0.89 | PDK2 (0.49) | MAPTSLC6A9KCNH2ESR2NR1H2 | |
| SCHEMBL4069676 | 0.85 | SLC6A9 (0.52) | SLC6A9KCNH2PDK2F10 | |
| SCHEMBL4070973 | 0.84 | SLC6A9 (0.44) | MAPTSLC6A9KCNH2PDK2 | |
| SCHEMBL12540737 | 0.83 | GRM1 (0.53) | MAPTSLC6A9ESR2NR1H2PDK2 | |
| SCHEMBL20792753 | 0.81 | PDK2 (0.56) | MAPTESR2NR1H2PDK2MAPK1 | |
| SCHEMBL18131950 | 0.80 | GRM1 (0.56) | MAPTESR2NR1H2PDK2MAPK1 | |
| SCHEMBL1018365 | 0.79 | ESR2 (0.46) | MAPTESR2NR1H2PDK2MAPK1 | |
| SCHEMBL12541075 | 0.79 | GRM5 (0.56) | MAPTESR2NR1H2PDK2MAPK1 | |
| SCHEMBL18149066 | 0.78 | PDK2 (0.51) | MAPTSLC6A9KCNH2ESR2NR1H2 | |
| SCHEMBL30090390 | 0.77 | PDK2 (0.48) | MAPTESR2NR1H2PDK2MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009100120-A2 | PYRIDINYL-SUBSTITUTED PIPERAZINYL OXOETHYL TETRAHYDROPYRAZOLOPYRIDINES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |
| WO-2009100120-A2 | PYRIDINYL-SUBSTITUTED PIPERAZINYL OXOETHYL TETRAHYDROPYRAZOLOPYRIDINES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |