Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.52 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30083519 | 1.00 | ADRB2 (0.52) | ADRB2LOXL2AOC3PIK3CDPIP5K1C | |
| SCHEMBL2556806 | 0.82 | ADRB2 (0.39) | ADRB2AOC3PIK3CDPIP5K1CPI4KA | |
| SCHEMBL24791668 | 0.81 | KDM4E (0.47) | LOXL2PIK3CDPI4KAPIK3CGPI4KB | |
| SCHEMBL6852510 | 0.78 | ADRB2 (0.36) | ADRB2AOC3PIK3CDPIP5K1CPI4KA | |
| SCHEMBL24791640 | 0.78 | BDKRB1 (0.40) | ADRB2CLK4DYRK1AVCPKAT6A | |
| SCHEMBL22044401 | 0.77 | LOXL2 (0.38) | LOXL2HDAC1HDAC6HDAC5BTK | |
| SCHEMBL27853917 | 0.77 | PSEN1 (0.43) | LOXL2HDAC1HDAC6HDAC5BTK | |
| SCHEMBL6642380 | 0.77 | NOTUM (0.47) | ADRB2PIK3CDPIP5K1CPI4KAPIK3CG | |
| SCHEMBL27612832 | 0.76 | AOC3 (0.37) | ADRB2AOC3PIK3CDPIP5K1CPI4KA | |
| SCHEMBL27352514 | 0.76 | TRPV1 (0.41) | — |
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-2022263604-A1 | SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE | Carrick Therapeutics Limited (IE) | 2022-12-22 | — | — | WO | disclosed |