Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.31 |
| ▸ | GABRE | P78334 | 1/20 | 0.31 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL8020079 | 0.80 | MAPK1 (0.34) | MEN1NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL9621372 | 0.79 | KDM4E (0.32) | KDM4EALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL26922197 | 0.75 | MAPK1 (0.32) | MAPK1SMN1; SMN2 | |
| SCHEMBL10393962 | 0.74 | MAPK1 (0.34) | MAPK1SMN1; SMN2 | |
| SCHEMBL2878722 | 0.73 | — | — | |
| SCHEMBL31207805 | 0.70 | GABRP (0.38) | NPC1RAB9AKDM4EGABRPGABRD | |
| SCHEMBL3062268 | 0.70 | HTT (0.31) | KDM4EALDH1A1 | |
| SCHEMBL31207803 | 0.70 | KDM4E (0.39) | KDM4EALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL16301663 | 0.70 | HTT (0.34) | KDM4EALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL28304032 | 0.70 | KDM4E (0.39) | KDM4EALDH1A1MAPK1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013027794-A1 | NOVEL COMPOUND AND USE THEREOF AS PDE10 INHIBITOR | 田辺三菱製薬株式会社 (JP) | 2013-02-28 | — | — | WO | disclosed |