Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 7/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.40 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29104106 | 1.00 | PIK3C3 (0.47) | PIK3C3BRD4DCTPP1SRCHTR6 | |
| SCHEMBL2674804 | 0.84 | PIK3C3 (0.48) | PIK3C3BRD4SRCHTR6PTGDR2 | |
| SCHEMBL16795088 | 0.84 | SRC (0.40) | PIK3C3DCTPP1SRCHTR6HTR1A | |
| SCHEMBL27522082 | 0.83 | CCR2 (0.48) | PIK3C3SRCHTR6PTGDR2PTGDR | |
| SCHEMBL7219174 | 0.82 | PPARG (0.40) | PIK3C3DCTPP1SRCHTR6PTGDR2 | |
| SCHEMBL7213656 | 0.80 | NOD2 (0.58) | HTR6PTGDR2PTGDRHTR1ADRD2 | |
| SCHEMBL16795048 | 0.80 | PPARG (0.46) | PIK3C3SRCHTR6PTGDR2HTR1A | |
| SCHEMBL16795075 | 0.80 | RECQL (0.39) | PIK3C3DCTPP1SRCHTR6PTGDR2 | |
| SCHEMBL18376651 | 0.80 | SRC (0.35) | PIK3C3DCTPP1SRCHTR6HTR1A | |
| SCHEMBL16809639 | 0.78 | PPARG (0.47) | PIK3C3SRCRECQL |
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-117003770-A | Fused pyrimidine compound or pharmaceutically acceptable salt thereof, and preparation method and application thereof | 南京师范大学 | 2023-11-07 | — | — | CN | disclosed |