Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADK | P55263 | 7/20 | 0.41 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 7/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | MARK3 | P27448 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.36 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29109224 | 1.00 | ADK (0.41) | ADKSLC29A1TLR8ADORA2ACYP1A2 | |
| SCHEMBL28589607 | 0.96 | ADK (0.42) | ADKSLC29A1TLR8ADORA2ACYP1A2 | |
| SCHEMBL16236531 | 0.90 | ADK (0.44) | ADKSLC29A1ADORA2ADYRK3ROCK2 | |
| SCHEMBL17356185 | 0.86 | ADK (0.43) | ADKSLC29A1DYRK3ROCK2PRKD3 | |
| SCHEMBL1585892 | 0.83 | ADK (0.40) | ADKSLC29A1DYRK3ROCK2PRKD3 | |
| SCHEMBL29503417 | 0.83 | ADK (0.46) | ADKSLC29A1ADORA2ADYRK3ROCK2 | |
| SCHEMBL16236999 | 0.83 | ADK (0.46) | ADKSLC29A1ADORA2ADYRK3ROCK2 | |
| SCHEMBL16236456 | 0.82 | ADK (0.43) | ADKSLC29A1DYRK3ROCK2PRKD3 | |
| SCHEMBL23966901 | 0.81 | ADK (0.48) | ADKSLC29A1ADORA2ACYP1A2DYRK3 | |
| SCHEMBL16236535 | 0.81 | ADK (0.44) | ADKSLC29A1DYRK3ROCK2PRKD3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117088886-A | Novel pyrrolo [2,3-d ] pyrimidine derivative containing coumarin, and preparation method and application thereof | 山东省药学科学院 | 2023-11-21 | — | — | CN | claimed |
| CN-117088886-A | Novel pyrrolo [2,3-d ] pyrimidine derivative containing coumarin, and preparation method and application thereof | 山东省药学科学院 | 2023-11-21 | — | — | CN | disclosed |