Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | IDH2 | P48735 | 1/20 | 0.39 |
| ▸ | BCDIN3D | Q7Z5W3 | 3/20 | 0.38 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | CTSC | P53634 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28378129 | 1.00 | TP53 (0.41) | TP53MAPTIDH2BCDIN3DNPY1R | |
| SCHEMBL28373456 | 0.88 | TERT (0.51) | TP53MAPTABCG2EGFRHTT | |
| SCHEMBL28373459 | 0.88 | TERT (0.51) | TP53MAPTABCG2EGFRHTT | |
| SCHEMBL28373321 | 0.82 | PTGS2 (0.42) | PDE5A | |
| SCHEMBL28373320 | 0.82 | PTGS2 (0.42) | PDE5A | |
| SCHEMBL28375715 | 0.81 | PDE5A (0.39) | BCDIN3DPDE5A | |
| Hydrochloric Acid SCHEMBL5356288 | 0.79 | ABCG2 (0.47) | TP53MAPTBCDIN3DABCG2CTSC | |
| SCHEMBL28375718 | 0.78 | TERT (0.57) | EGFR | |
| SCHEMBL28375719 | 0.78 | TERT (0.57) | EGFR | |
| SCHEMBL28374607 | 0.77 | PDE5A (0.43) | PDE5A |
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-108503648-B | Styryl pyrazolopyrimidine compound, pharmaceutical composition, preparation method and application | 安徽医科大学 | 2020-04-14 | — | — | CN | disclosed |