Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK2 | P49760 | 4/20 | 0.47 |
| ▸ | CLK3 | P49761 | 4/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.47 |
| ▸ | WNT1 | P04628 | 3/20 | 0.47 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | ACACA | Q13085 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28079206 | 0.77 | DYRK1A (0.69) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL28079290 | 0.76 | PRKAG1 (0.48) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL13554360 | 0.75 | JAK2 (0.50) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL8877161 | 0.72 | JAK2 (0.54) | CLK2CLK3DYRK1AWNT1NTRK1 | |
| SCHEMBL12339927 | 0.71 | GSK3B (0.49) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL3603302 | 0.71 | WNT1 (0.40) | CLK2CLK3DYRK1AWNT1ACACB | |
| SCHEMBL28258471 | 0.70 | NTRK1 (0.43) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL23368472 | 0.70 | GSK3B (0.47) | CLK2CLK3DYRK1AWNT1GSK3B | |
| Hydrochloric Acid SCHEMBL27980243 | 0.69 | ULK1 (0.45) | CLK2CLK3DYRK1AWNT1GSK3B | |
| SCHEMBL591164 | 0.69 | HTR1A (0.48) | CLK2CLK3DYRK1AWNT1GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| CN-104193741-B | Quinuclidine-4-ylmethyl 1H-indole-3-carboxylic acid ester derivant as alpha 7 nicotinic acetylcholine receptor ligands | 阿尔法梅根有限责任公司 | 2016-08-24 | — | — | CN | disclosed |