Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29063417 | 1.00 | LMNA (0.41) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL3257703 | 0.81 | FDPS (0.40) | LMNAHSD17B10FDPSTSHRSMPD1 | |
| SCHEMBL29063524 | 0.80 | CTSK (0.34) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL27616716 | 0.80 | TSHR (0.42) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL10794662 | 0.80 | ALDH1A1 (0.39) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL4346472 | 0.79 | LMNA (0.44) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL16244342 | 0.79 | LMNA (0.44) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL31629723 | 0.76 | SMPD1 (0.42) | FDPSSMPD1 | |
| SCHEMBL19924985 | 0.76 | LMNA (0.41) | LMNAHSD17B10CA1CA2FDPS | |
| SCHEMBL1811804 | 0.74 | LMNA (0.40) | LMNAHSD17B10CA1CA2FDPS |
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-116693527-A | Pyrimido aromatic ring compounds and application thereof in medicines | 广东东阳光药业股份有限公司 | 2023-09-05 | — | — | CN | disclosed |