Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 5/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3625416 | 0.87 | KDM4E (0.34) | GABRA2GABRB2GFERKDM4EMAPK1 | |
| SCHEMBL3627357 | 0.86 | ALDH1A1 (0.35) | GFERKDM4EMAPK1 | |
| SCHEMBL3627548 | 0.86 | COMT (0.33) | GABRA2GABRB2GFERKDM4EMAPK1 | |
| SCHEMBL3634680 | 0.84 | GRIA1 (0.35) | GRIA2GRIA4KDM4EMAPK1 | |
| SCHEMBL3633919 | 0.83 | MEN1 (0.45) | GFERKDM4EMAPK1 | |
| SCHEMBL3628060 | 0.79 | ALKBH5 (0.37) | KDM4E | |
| SCHEMBL3635017 | 0.77 | GABRA2 (0.36) | GABRA2GABRB2GRIA2GRIA4KDM4E | |
| SCHEMBL3632144 | 0.77 | ABCB1 (0.37) | GABRA2GABRB2KDM4E | |
| SCHEMBL3631893 | 0.77 | GABRA2 (0.47) | GABRA2GABRB2KDM4EMAPK1 | |
| SCHEMBL3632542 | 0.75 | KMT2A (0.43) | GABRA2GABRB2KDM4EMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2150534-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2010-02-10 | — | — | EP | claimed |
| WO-2008131779-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2008-11-06 | — | — | WO | claimed |
| EP-2150534-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008131779-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2008-11-06 | — | — | WO | disclosed |