Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | TACR3 | P29371 | 5/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL2477280 | 0.92 | SLC6A2 (0.47) | SLC6A2SLC6A4SSTR4MAOB | |
| SCHEMBL2477910 | 0.88 | TMEM97 (0.42) | SLC6A2 | |
| SCHEMBL2476151 | 0.88 | TACR3 (0.40) | RORCCNR1CNR2SLC6A2TACR1 | |
| SCHEMBL2481591 | 0.83 | TACR3 (0.41) | TACR1TACR3SLC6A4 | |
| SCHEMBL5791908 | 0.75 | HSD11B1 (0.44) | MAOB | |
| SCHEMBL3744181 | 0.75 | HSD11B1 (0.44) | MAOB | |
| SCHEMBL5788833 | 0.73 | SIGMAR1 (0.46) | — | |
| N-Benzylmethylamine SCHEMBL2477939 | 0.73 | SLC6A4 (0.44) | RORCSLC6A2TACR3SLC6A4OPRL1 | |
| SCHEMBL17735432 | 0.71 | SLC6A4 (0.56) | SLC6A2SLC6A4OPRL1OPRM1 | |
| SCHEMBL2477938 | 0.71 | TACR3 (0.60) | SLC6A2TACR3SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1656349-B1 | CYCLOPROPYL DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | LUNDBECK & CO AS H (DK) | 2011-10-12 | — | — | EP | disclosed |