Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 4/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.35 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | C1R | P00736 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29646053 | 0.93 | ADORA3 (0.41) | ADORA3ADORA1ADORA2AAURKBMAP3K12 | |
| SCHEMBL29645835 | 0.87 | ADORA3 (0.39) | ADORA3ADORA1ADORA2AAURKBMET | |
| SCHEMBL29645782 | 0.87 | MAPT (0.43) | ADORA3ADORA1ADORA2AALK | |
| SCHEMBL29645919 | 0.86 | MAPT (0.41) | ADORA3AURKBMETTTK | |
| SCHEMBL29645823 | 0.84 | THRB (0.45) | ADORA3ADORA1ADORA2A | |
| SCHEMBL29645874 | 0.84 | ADORA3 (0.40) | ADORA3ADORA1ADORA2AMETALK | |
| SCHEMBL29646322 | 0.83 | RXFP1 (0.40) | ADORA3ADORA1ADORA2AALK | |
| SCHEMBL29646031 | 0.83 | KDR (0.33) | ADORA3ADORA1ADORA2AAURKBMET | |
| SCHEMBL29645783 | 0.82 | ADORA3 (0.42) | ADORA3 | |
| SCHEMBL29645842 | 0.82 | MET (0.33) | ADORA3ADORA1ADORA2AMETALK |
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-114466850-A | [1,2,4] triazolo [1,5-C ] quinazolin-5-amines | 拜耳股份有限公司 | 2022-05-10 | — | — | CN | claimed |