Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 3/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL6369816 | 0.81 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3NTRK1 | |
| SCHEMBL1614612 | 0.80 | SLC6A2 (0.43) | GRIN1GRIN2BSIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL3923122 | 0.80 | SIGMAR1 (0.73) | GRIN1GRIN2BSIGMAR1 | |
| SCHEMBL13109615 | 0.79 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3NTRK1 | |
| SCHEMBL21890589 | 0.79 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3NTRK1 | |
| SCHEMBL10387940 | 0.79 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3NTRK1 | |
| Hydrochloric Acid SCHEMBL38655639 | 0.79 | GRIN1 (0.48) | GRIN1GRIN2BSIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL13100647 | 0.77 | SLC6A2 (0.43) | SIGMAR1SLC6A2SLC6A4SLC6A3NTRK1 | |
| SCHEMBL10132278 | 0.77 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3NTRK1 | |
| SCHEMBL4026570 | 0.77 | SLC6A2 (0.64) | SIGMAR1SLC6A2SLC6A4SLC6A3 |
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-2009005459-A1 | PHENYL-1,2, 3,4-TETRAHYDROISOQUINOLINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF A PAIN DISORDER | ASTRAZENECA AB (SE) | 2009-01-08 | — | — | WO | disclosed |