Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 2/20 | 0.40 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2481589 | 0.88 | RORC (0.41) | TACR3SSTR4SLC6A2SLC6A4TACR1 | |
| SCHEMBL2477280 | 0.86 | SLC6A2 (0.47) | SSTR4SLC6A2SLC6A4 | |
| SCHEMBL2477910 | 0.85 | TMEM97 (0.42) | SLC6A2 | |
| SCHEMBL2481591 | 0.85 | TACR3 (0.41) | TACR3SLC6A4TACR1 | |
| SCHEMBL3743997 | 0.77 | CCR2 (0.43) | TACR3CCR2SLC6A2SLC6A4 | |
| SCHEMBL6023197 | 0.77 | CCR2 (0.43) | TACR3CCR2SLC6A2SLC6A4 | |
| SCHEMBL5792435 | 0.75 | SIGMAR1 (0.42) | CCR2 | |
| N-Benzylmethylamine SCHEMBL2477949 | 0.75 | TACR3 (0.40) | TACR3CCR2SLC6A2SLC6A4 | |
| N-Benzylmethylamine SCHEMBL5792207 | 0.75 | TACR3 (0.40) | TACR3CCR2SLC6A2SLC6A4 | |
| SCHEMBL5792205 | 0.72 | TACR3 (0.59) | TACR3TACR1 |
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 |