Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | FGF23 | Q9GZV9 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL2161078 | 1.00 | HPGD (0.43) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL2161083 | 1.00 | HPGD (0.43) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL31251566 | 0.81 | SMN1; SMN2 (0.38) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL21283428 | 0.79 | CA1 (0.41) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL20878219 | 0.79 | TSHR (0.45) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL5616265 | 0.79 | CA1 (0.41) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL2494214 | 0.78 | SMN1; SMN2 (0.55) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL2492408 | 0.78 | CA12 (0.52) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL2492402 | 0.78 | SIRT2 (0.52) | HPGDALDH1A1SMN1; SMN2HTTTSHR | |
| SCHEMBL2494211 | 0.78 | SMN1; SMN2 (0.55) | HPGDALDH1A1SMN1; SMN2HTTTSHR |
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-117794924-A | Compounds useful as inhibitors of ATR kinase | 苏州爱科百发生物医药技术有限公司 | 2024-03-29 | — | — | CN | disclosed |