Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 8/20 | 0.74 |
| ▸ | TACR1 | P25103 | 5/20 | 0.74 |
| ▸ | TACR2 | P21452 | 3/20 | 0.74 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | UBE2M | P61081 | 2/20 | 0.37 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.37 |
| ▸ | CCR1 | P32246 | 2/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL295924 | 0.99 | TACR3 (0.75) | TACR3TACR1TACR2HRH1CCR3 | |
| SCHEMBL296792 | 0.94 | TACR3 (0.67) | TACR3TACR1TACR2HRH1CCR3 | |
| SCHEMBL296922 | 0.94 | TACR3 (0.66) | TACR3TACR1TACR2HRH1CCR3 | |
| SCHEMBL296239 | 0.92 | TACR3 (0.60) | TACR3TACR1TACR2HRH1CCR3 | |
| SCHEMBL297234 | 0.91 | TACR3 (0.76) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL296503 | 0.91 | TACR3 (0.63) | TACR3TACR1TACR2HRH1CCR3 | |
| SCHEMBL3271088 | 0.89 | TACR3 (0.80) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL295923 | 0.88 | TACR3 (0.81) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL295074 | 0.88 | TACR3 (0.73) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL295073 | 0.88 | TACR3 (0.80) | TACR3TACR1TACR2UBE2MDCUN1D1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2200982-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2010-06-30 | — | — | EP | disclosed |
| WO-2009033995-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-03-19 | — | — | WO | disclosed |