Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28686966 | 0.80 | EP300 (0.44) | CCNT1CDK9SUV39H2GCKKDM4E | |
| SCHEMBL18330519 | 0.80 | SUV39H2 (0.44) | CCNT1CDK9PDE3BPDE3ASUV39H2 | |
| SCHEMBL26062788 | 0.76 | CCNT1 (0.33) | CCNT1CDK9PDCD1CD274PDE3B | |
| SCHEMBL20764947 | 0.76 | TDP1 (0.38) | CCNT1CDK9PDE3BPDE3ASUV39H2 | |
| SCHEMBL30439702 | 0.76 | TDP1 (0.38) | CCNT1CDK9PDE3BPDE3ASUV39H2 | |
| SCHEMBL16437271 | 0.74 | SUV39H2 (0.40) | CCNT1CDK9PDE3BPDE3ASUV39H2 | |
| SCHEMBL29889169 | 0.73 | TUBB4A (0.45) | CCNT1CDK9PDCD1CD274PDE3B | |
| SCHEMBL26530979 | 0.72 | PDCD1 (0.49) | PDCD1CD274PDE3BPDE3APIK3CD | |
| SCHEMBL20795222 | 0.71 | CCNT1 (0.35) | CCNT1CDK9PDE3BPDE3ASUV39H2 | |
| SCHEMBL12326162 | 0.71 | ACHE (0.44) | ALDH1A1KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-3672951-B1 | QUINOXALINE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2023-08-30 | — | — | EP | disclosed |