Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 15/20 | 0.46 |
| ▸ | CCR5 | P51681 | 2/20 | 0.45 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8048710 | 0.90 | SLC6A3 (0.50) | TACR2TACR1SLC6A3 | |
| SCHEMBL295981 | 0.84 | TACR2 (0.45) | TACR2CCR5TACR1MCHR1 | |
| SCHEMBL10569422 | 0.77 | GRIN2B (0.56) | TACR2SLC6A3 | |
| SCHEMBL3637661 | 0.76 | TACR2 (0.44) | TACR2CCR5TACR1SLC6A3 | |
| SCHEMBL295129 | 0.74 | SLC6A3 (0.49) | TACR2CCR5TACR1SLC6A3 | |
| SCHEMBL8033015 | 0.74 | KCNH2 (0.43) | TACR2TACR1MCHR1 | |
| SCHEMBL295967 | 0.71 | EPHX2 (0.43) | TACR2CCR5TACR1MCHR1 | |
| SCHEMBL9734602 | 0.71 | SLC6A3 (0.54) | TACR2TACR1MCHR1SLC6A3 | |
| SCHEMBL297293 | 0.70 | TACR3 (0.48) | TACR2CCR5TACR1 | |
| SCHEMBL8095001 | 0.69 | SLC6A3 (0.55) | TACR2TACR1SLC6A3 |
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 |