Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 9/20 | 0.33 |
| ▸ | GSK3B | P49841 | 8/20 | 0.33 |
| ▸ | WNT1 | P04628 | 5/20 | 0.33 |
| ▸ | CLK2 | P49760 | 2/20 | 0.33 |
| ▸ | CLK3 | P49761 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 2/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.31 |
| ▸ | TYK2 | P29597 | 2/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.31 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.31 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.31 |
| ▸ | TTK | P33981 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23048883 | 0.84 | NNMT (0.36) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL20938733 | 0.84 | NNMT (0.39) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23740730 | 0.76 | NNMT (0.36) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23740771 | 0.75 | DYRK1A (0.36) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL4404906 | 0.75 | HCAR3 (0.44) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23048630 | 0.73 | HCAR3 (0.34) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23916312 | 0.73 | ACACB (0.35) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23048634 | 0.72 | TTK (0.33) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL24219443 | 0.71 | ACACB (0.35) | NNMTDYRK1AGSK3BWNT1CLK2 | |
| SCHEMBL23048641 | 0.71 | ACACB (0.32) | NNMTDYRK1AGSK3BWNT1CLK2 |
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 |