Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.32 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 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 | |
|---|---|---|---|---|
| SCHEMBL23408817 | 1.00 | IRAK4 (0.36) | IRAK4MAOBPIM1DYRK1ADYRK2 | |
| SCHEMBL23408752 | 0.85 | DYRK1A (0.35) | IRAK4MAOBPIM1DYRK1ADYRK2 | |
| SCHEMBL23408584 | 0.85 | DYRK1A (0.35) | IRAK4MAOBPIM1DYRK1ADYRK2 | |
| SCHEMBL23408617 | 0.80 | MAPT (0.41) | IRAK4PIM1DYRK1AMAPTNTRK1 | |
| SCHEMBL23408583 | 0.79 | NTRK1 (0.48) | NTRK1 | |
| SCHEMBL23408672 | 0.79 | NTRK1 (0.48) | NTRK1 | |
| SCHEMBL23408651 | 0.78 | PIM1 (0.32) | IRAK4PIM1DYRK1ADYRK2DYRK1B | |
| SCHEMBL23408679 | 0.77 | NTRK1 (0.35) | PIM1MAPTNTRK1CCNT1CDK9 | |
| SCHEMBL23408626 | 0.77 | IRAK4 (0.38) | IRAK4PIM1DYRK1ADYRK2DYRK1B | |
| SCHEMBL23408809 | 0.76 | PIM1 (0.33) | IRAK4PIM1DYRK1ADYRK2DYRK1B |
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-2021098745-A1 | PREPARATION AND APPLICATION OF A CLASS OF PROTEIN RECEPTOR KINASE INHIBITORS | 上海轶诺药业有限公司 | 2021-05-27 | — | — | WO | disclosed |