Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT1 | P04628 | 4/20 | 0.41 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19546938 | 0.86 | WNT1 (0.39) | WNT1GSK3BDYRK1AMEN1GAA | |
| SCHEMBL23048639 | 0.84 | WNT1 (0.38) | WNT1GSK3BDYRK1AKDM2BHRH4 | |
| SCHEMBL20951081 | 0.77 | KDM2B (0.54) | WNT1GSK3BDYRK1AALDH1A1MAPT | |
| SCHEMBL8302529 | 0.73 | EHMT2 (0.42) | WNT1GSK3BDYRK1AALDH1A1MEN1 | |
| SCHEMBL20951194 | 0.72 | WNT1 (0.49) | WNT1GSK3BDYRK1AKMT2AKDM2B | |
| SCHEMBL23048776 | 0.71 | WNT1 (0.42) | WNT1GSK3BDYRK1AALDH1A1MEN1 | |
| SCHEMBL28531937 | 0.70 | ALDH1A1 (0.42) | ALDH1A1MAPTHPGD | |
| SCHEMBL19547056 | 0.69 | HRH4 (0.55) | ALDH1A1MEN1GAAKMT2AHRH4 | |
| SCHEMBL16293110 | 0.69 | KDM2B (0.38) | GSK3BKDM2B | |
| SCHEMBL8302411 | 0.68 | TLR9 (0.37) | WNT1GSK3BDYRK1AGAAKDM2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3448386-B1 | ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED LLC (US) | 2021-03-03 | — | — | EP | disclosed |