Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 10/20 | 0.55 |
| ▸ | RORC | P51449 | 8/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 5/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16239847 | 0.90 | TACR3 (0.53) | TACR3RORCNR1I2 | |
| SCHEMBL16239921 | 0.87 | TACR3 (0.55) | TACR3RORCNR1I2 | |
| SCHEMBL16239791 | 0.85 | TACR3 (0.56) | TACR3 | |
| SCHEMBL16239849 | 0.81 | TACR3 (0.58) | TACR3RORC | |
| SCHEMBL16239565 | 0.80 | TACR3 (0.60) | TACR3SMN1; SMN2 | |
| SCHEMBL16239673 | 0.79 | TACR3 (0.73) | TACR3RORCNR1I2 | |
| SCHEMBL16239795 | 0.79 | TACR3 (0.68) | TACR3CCR1 | |
| SCHEMBL16239696 | 0.72 | TACR3 (0.53) | TACR3RORCNR1I2ALDH1A1 | |
| SCHEMBL16239718 | 0.71 | CCR3 (0.43) | RORCNR1I2 | |
| SCHEMBL10277629 | 0.71 | TACR3 (1.00) | TACR3 |
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-2661432-B1 | PYRROLIDINE DERIVATIVES AS NK3 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2014-11-19 | — | — | EP | claimed |