Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 4/20 | 0.44 |
| ▸ | AR | P10275 | 2/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TEC | P42680 | 1/20 | 0.42 |
| ▸ | TXK | P42681 | 1/20 | 0.42 |
| ▸ | BMX | P51813 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27364070 | 0.86 | KLKB1 (0.55) | ADORA2BALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL27286146 | 0.81 | MAOB (0.47) | ADORA2BALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL2686093 | 0.79 | HSD17B10 (0.48) | ALDH1A1KLKB1POLBKIF11HSD17B10 | |
| SCHEMBL752774 | 0.79 | LMNA (0.61) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL27286282 | 0.78 | KLKB1 (0.47) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL21493002 | 0.78 | PPARD (0.42) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL30744539 | 0.78 | PPARD (0.42) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL18996861 | 0.78 | ADORA2B (0.44) | ADORA2BALDH1A1LMNAMAPTKCNH2 | |
| SCHEMBL27364059 | 0.76 | LMNA (0.49) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL27286280 | 0.76 | MAOA (0.49) | ADORA2BALDH1A1MAPTKLKB1AR |
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-2024026483-A2 | CDK2 INHIBITORS AND METHODS OF USING THE SAME | CEDILLA THERAPEUTICS, INC. (US) | 2024-02-01 | — | — | WO | disclosed |