Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.49 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.49 |
| ▸ | STAT3 | P40763 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL357927 | 0.94 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| Hydrochloric Acid SCHEMBL5013604 | 0.93 | ALDH1A1 (0.69) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL2129780 | 0.87 | ALDH1A1 (0.66) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL30289763 | 0.87 | UBE2T (0.71) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL29475033 | 0.87 | UBE2T (0.71) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL30415822 | 0.85 | UBE2T (0.69) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL27739969 | 0.85 | UBE2T (0.69) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| Hydrochloric Acid SCHEMBL5010433 | 0.85 | UBE2T (0.69) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| SCHEMBL29074197 | 0.85 | UBE2T (0.69) | ALDH1A1HPGDKDM4EPOLBALOX15 | |
| Hydrochloric Acid SCHEMBL5008434 | 0.84 | UBE2T (0.67) | ALDH1A1HPGDKDM4EPOLBALOX15 |
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-102746285-B | Compounds and compositions as HEDGEHOG pathway modulators | 太阳制药国际公司 | 2022-01-14 | — | — | CN | disclosed |