Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK2 | P49760 | 1/20 | 0.48 |
| ▸ | GSK3A | P49840 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | CDK9 | P50750 | 1/20 | 0.48 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2781877 | 0.85 | GSK3B (0.51) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2781207 | 0.84 | ABCB1 (0.42) | ABCB1ABCC1KMT2AGAAWNT3A | |
| SCHEMBL2780985 | 0.83 | CLK2 (0.50) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2781682 | 0.83 | CLK2 (0.50) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2780813 | 0.82 | CLK2 (0.49) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2781549 | 0.80 | CLK4 (0.48) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2779819 | 0.80 | CLK2 (0.48) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2781794 | 0.79 | CLK4 (0.48) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL2782306 | 0.79 | GRIN2B (0.54) | CLK2GSK3AGSK3BCDK9CDK5 | |
| SCHEMBL17620898 | 0.77 | KMT2A (0.48) | ABCB1ABCC1KMT2AGAAATM |
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 |
|---|---|---|---|---|---|---|---|
| US-9296697-B2 | Hetaryl-substituted guanidine compounds and use thereof as binding partners for 5-HT5-receptors | ABBOTT LABORATORIES (US) | 2016-03-29 | — | — | US | claimed |