Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 9/20 | 0.60 |
| ▸ | TACR1 | P25103 | 8/20 | 0.49 |
| ▸ | TACR2 | P21452 | 3/20 | 0.49 |
| ▸ | UBE2M | P61081 | 1/20 | 0.38 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 9/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3275834 | 0.94 | TACR3 (0.69) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL297449 | 0.89 | TACR3 (0.68) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL296806 | 0.89 | TACR3 (0.68) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL296656 | 0.83 | TACR3 (0.77) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL297453 | 0.83 | TACR3 (0.77) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL8053227 | 0.82 | TACR3 (0.71) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL8049889 | 0.81 | TACR3 (0.68) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL296859 | 0.81 | TACR3 (0.68) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL297239 | 0.81 | TACR3 (0.68) | TACR3TACR1TACR2UBE2MDCUN1D1 | |
| SCHEMBL296877 | 0.81 | TACR3 (0.89) | TACR3TACR1TACR2CCR5 |
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 | claimed |
| WO-2009033995-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-03-19 | — | — | WO | claimed |