Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.32 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.31 |
| ▸ | UGCG | Q16739 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL33526079 | 0.86 | IL1RN (0.33) | GRM2WNT3ATNKS2 | |
| SCHEMBL2149255 | 0.74 | DRD2 (0.44) | — | |
| SCHEMBL1550867 | 0.74 | HTR2A (0.34) | HTR2AGRM2WNT3ATNKS2 | |
| SCHEMBL33526989 | 0.73 | KDM1A (0.32) | GRM2WNT3ATNKS2 | |
| SCHEMBL31518138 | 0.70 | ABCC9 (0.36) | — | |
| SCHEMBL23976544 | 0.69 | SRD5A1 (0.39) | HTR2A | |
| SCHEMBL30060662 | 0.69 | SRD5A1 (0.39) | HTR2A | |
| SCHEMBL30062825 | 0.69 | DRD2 (0.33) | — | |
| SCHEMBL23976551 | 0.69 | DRD2 (0.33) | — | |
| SCHEMBL30977517 | 0.68 | HTR2A (0.39) | HTR2ASLC6A4 |
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-2342182-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2011-07-13 | — | — | EP | disclosed |
| WO-2010028655-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2010-03-18 | — | — | WO | disclosed |