Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 12/20 | 0.47 |
| ▸ | TACR2 | P21452 | 5/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.43 |
| ▸ | KCNK3 | O14649 | 6/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1717248 | 0.99 | TACR3 (0.49) | TACR3TACR2OPRM1KCNK3TRPV4 | |
| SCHEMBL1717767 | 0.94 | TACR3 (0.45) | TACR3TACR2OPRM1KCNK3 | |
| SCHEMBL1717260 | 0.92 | TACR3 (0.45) | TACR3TACR2OPRM1KCNK3CACNA1H | |
| SCHEMBL1718258 | 0.92 | TACR3 (0.53) | TACR3TACR2OPRM1KCNK3 | |
| SCHEMBL1717592 | 0.91 | TACR3 (0.48) | TACR3TACR2OPRM1KCNK3TRPV4 | |
| SCHEMBL1717938 | 0.91 | TACR3 (0.48) | TACR3TACR2OPRM1KCNK3TRPV4 | |
| SCHEMBL1717866 | 0.91 | TACR3 (0.49) | TACR3TACR2OPRM1KCNK3 | |
| SCHEMBL1717394 | 0.91 | TACR3 (0.54) | TACR3TACR2OPRM1KCNK3 | |
| SCHEMBL1717925 | 0.91 | TACR3 (0.49) | TACR3TACR2OPRM1KCNK3TRPV4 | |
| SCHEMBL1718017 | 0.91 | TACR3 (0.49) | TACR3TACR2OPRM1KCNK3TRPV4 |
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-2150534-B1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | LUNDBECK & CO AS H (DK) | 2012-01-11 | — | — | EP | claimed |
| EP-2150534-B1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | LUNDBECK & CO AS H (DK) | 2012-01-11 | — | — | EP | disclosed |