Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | KIF11 | P52732 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TOP1 | P11387 | 2/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3898550 | 0.94 | ADORA2A (0.72) | ADORA2AADORA1ADORA3KIF11KDM4E | |
| SCHEMBL3898780 | 0.92 | ADORA2A (0.51) | ADORA2AADORA1ADORA3KIF11KDM4E | |
| SCHEMBL22234018 | 0.91 | KIF11 (0.52) | ADORA2AADORA1ADORA3KIF11DPP4 | |
| SCHEMBL3910159 | 0.86 | ADORA2A (0.53) | ADORA2AADORA1ADORA3KIF11KDM4E | |
| SCHEMBL2088245 | 0.84 | KIF11 (0.48) | ADORA2AADORA3KIF11KDM4ELTA4H | |
| SCHEMBL29894012 | 0.83 | S1PR1 (0.46) | ADORA2AADORA1ADORA3KIF11KDM4E | |
| SCHEMBL29893642 | 0.83 | KDM4E (0.46) | ADORA2AADORA1ADORA3KIF11KDM4E | |
| SCHEMBL6531140 | 0.82 | ADORA2A (0.54) | ADORA2AADORA1ADORA3KDM4EALDH1A1 | |
| SCHEMBL1257904 | 0.81 | KIF11 (0.56) | ADORA3KIF11KDM4EDPP4LTA4H | |
| SCHEMBL6528840 | 0.81 | S1PR1 (0.54) | KDM4EALDH1A1MEN1MAPTHPGD |
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-105683166-A | Substituted pyrimidine Bmi-1 inhibitors | PTC医疗公司 | 2016-06-15 | — | — | CN | disclosed |