Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 17/20 | 0.43 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4188987 | 0.82 | SLC6A9 (0.40) | SLC6A9SLC6A5 | |
| SCHEMBL4186582 | 0.78 | SLC6A9 (0.51) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL3708922 | 0.78 | SLC6A9 (0.51) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL4184530 | 0.78 | SLC6A9 (0.51) | SLC6A9SLC6A5CYP2D6 | |
| Hydrochloric Acid SCHEMBL3715831 | 0.77 | SLC6A9 (0.50) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL4184268 | 0.71 | OPRD1 (0.38) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL3706694 | 0.71 | OPRD1 (0.38) | SLC6A9SLC6A5CYP2D6 | |
| Hydrochloric Acid SCHEMBL4184756 | 0.70 | OPRD1 (0.37) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL2123914 | 0.68 | SLC6A9 (0.49) | SLC6A9SLC6A5CYP2D6 | |
| SCHEMBL4183539 | 0.68 | SLC6A9 (0.41) | SLC6A9SLC6A5 |
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-2009013535-A1 | 2-AZABICYCLO(2.2.2)OCTANE DERIVATIVES AS MODULATORS OF THE GLYCINE TRANSPORTER I RECEPTOR | ASTRAZENECA AB (SE) | 2009-01-29 | — | — | WO | disclosed |