Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.50 |
| ▸ | TACR2 | P21452 | 6/20 | 0.45 |
| ▸ | TACR1 | P25103 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8048680 | 0.90 | TACR2 (0.46) | SLC6A3TACR2TACR1 | |
| SCHEMBL295129 | 0.85 | SLC6A3 (0.49) | SLC6A3TACR2TACR1SLC6A2SLC6A4 | |
| SCHEMBL9734602 | 0.82 | SLC6A3 (0.54) | SLC6A3TACR2TACR1SLC6A2SLC6A4 | |
| SCHEMBL8095001 | 0.81 | SLC6A3 (0.55) | SLC6A3TACR2TACR1SLC6A2SLC6A4 | |
| SCHEMBL3637256 | 0.78 | SLC6A3 (0.45) | SLC6A3TACR2TACR1SLC6A2SLC6A4 | |
| SCHEMBL295981 | 0.74 | TACR2 (0.45) | TACR2TACR1 | |
| SCHEMBL2650793 | 0.71 | SLC6A3 (0.58) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL631558 | 0.71 | SLC6A3 (0.50) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL8033015 | 0.70 | KCNH2 (0.43) | TACR2TACR1 | |
| SCHEMBL10650297 | 0.70 | SLC6A3 (0.49) | SLC6A3SLC6A2SLC6A4 |
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-2009033995-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-03-19 | — | — | WO | disclosed |