Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27996594 | 1.00 | MEN1 (0.51) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL7759078 | 0.98 | KDM4E (0.51) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL29868676 | 0.98 | KDM4E (0.51) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL27577140 | 0.94 | KDM4E (0.53) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL4778415 | 0.87 | KDM4E (0.55) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL28340518 | 0.84 | ALDH1A1 (0.43) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL7509399 | 0.81 | KDM4E (0.60) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL29361631 | 0.81 | KDM4E (0.60) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL1553541 | 0.78 | KDM4E (0.50) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL9095677 | 0.77 | KDM4E (0.55) | KDM4EALDH1A1NOS3NOS2GLA |
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-1896419-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006129978-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2006-12-07 | — | — | WO | disclosed |