Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 8/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 8/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 4/20 | 0.46 |
| ▸ | DHODH | Q02127 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL20142391 | 0.90 | EPHX2 (0.48) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142497 | 0.89 | CCNA2 (0.55) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142267 | 0.87 | GSK3A (0.51) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142465 | 0.87 | CDK5 (0.52) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20141898 | 0.83 | CDK5 (0.71) | CDK5CDK5R1CCNA2CDK2MAPT | |
| SCHEMBL20142504 | 0.81 | CCNA2 (0.49) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142105 | 0.78 | CDK5 (0.67) | CDK5CDK5R1CCNA2CDK2MAPT | |
| SCHEMBL20142841 | 0.77 | MAPT (0.63) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142452 | 0.77 | NPC1 (0.50) | CDK5CDK5R1ADORA3ADORA2AADORA1 | |
| SCHEMBL20142402 | 0.76 | NPC1 (0.57) | CDK5CDK5R1CCNA2CDK2DHODH |
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-2018089902-A1 | DIAMINOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | APOGEE BIOTECHNOLOGY CORPORATION (US) | 2018-05-17 | — | — | WO | disclosed |