Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 2/20 | 0.35 |
| ▸ | CHKB | Q9Y259 | 1/20 | 0.35 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | ADCYAP1R1 | P41586 | 1/20 | 0.34 |
| ▸ | NT5E | P21589 | 3/20 | 0.34 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.33 |
| ▸ | BTK | Q06187 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL31617909 | 1.00 | CHKA (0.35) | CHKACHKBTNK2MCHR1ADCYAP1R1 | |
| SCHEMBL25049292 | 0.91 | MCHR1 (0.35) | MCHR1ADCYAP1R1SCN9AKCNH2MAP4K1 | |
| SCHEMBL25046778 | 0.89 | CHKA (0.37) | CHKACHKBNT5ESCN9ABTK | |
| SCHEMBL25049274 | 0.81 | CHKA (0.35) | CHKACHKBNT5E | |
| SCHEMBL25048808 | 0.80 | NT5E (0.39) | NT5E | |
| SCHEMBL25049069 | 0.78 | CHKA (0.33) | CHKACHKBDHFR | |
| SCHEMBL25046765 | 0.78 | ADRA1A (0.40) | CHKACHKB | |
| SCHEMBL25046781 | 0.77 | CHKA (0.38) | CHKACHKBMCHR1RIPK2 | |
| SCHEMBL25048385 | 0.77 | ROCK2 (0.39) | CHKANT5E | |
| SCHEMBL25048345 | 0.76 | CHKA (0.35) | CHKACHKBNT5E |
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-2023017152-A1 | SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION | ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) | 2023-02-16 | — | — | WO | disclosed |