Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | METTL3 | Q86U44 | 2/20 | 0.33 |
| ▸ | METTL14 | Q9HCE5 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.32 |
| ▸ | BAD | Q92934 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
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 | 0.89 | KDM4E (0.34) | KDM4EGABRA2GABRB2NOTUMMAPT | |
| SCHEMBL3633608 | 0.81 | ABCB1 (0.53) | ABCB1LMNAKDM4EGABRA2GABRB2 | |
| SCHEMBL3635017 | 0.81 | GABRA2 (0.36) | KDM4EGABRA2GABRB2KMT2AMEN1 | |
| SCHEMBL3628060 | 0.81 | ALKBH5 (0.37) | LMNAKDM4EKMT2AMEN1TP53 | |
| SCHEMBL3631576 | 0.77 | ALDH1A1 (0.35) | LMNAKDM4EKMT2AMEN1ATM | |
| SCHEMBL3634602 | 0.77 | NR4A3 (0.37) | KDM4EGABRA2GABRB2 | |
| SCHEMBL3632208 | 0.75 | MAPK1 (0.35) | LMNAKDM4E | |
| SCHEMBL3627357 | 0.74 | ALDH1A1 (0.35) | LMNAKDM4EATMMAPT | |
| SCHEMBL3627548 | 0.74 | COMT (0.33) | LMNAKDM4EGABRA2GABRB2KMT2A | |
| SCHEMBL3634680 | 0.74 | GRIA1 (0.35) | LMNAKDM4EKMT2AMEN1 |
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-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 |