Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HNF4A | P41235 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10596740 | 0.95 | KDM4E (0.40) | KDM4EPOLBALDH1A1GAAHPGD | |
| SCHEMBL2961433 | 0.89 | TDP1 (0.37) | KDM4EPOLBALDH1A1GAAHPGD | |
| SCHEMBL3983271 | 0.81 | HTR1B (0.40) | KDM4EALDH1A1TSHRHSD17B10TLR8 | |
| SCHEMBL16684493 | 0.81 | MAPT (0.43) | GAAMAPTTLR8CNR1CNR2 | |
| SCHEMBL6002752 | 0.81 | MAPT (0.30) | ALDH1A1MAPTTSHRHSD17B10 | |
| SCHEMBL1746782 | 0.80 | MAOB (0.40) | KDM4EALDH1A1GAAHPGDMAPT | |
| SCHEMBL2090532 | 0.80 | MAPT (0.33) | ALDH1A1HPGDMAPT | |
| SCHEMBL16684497 | 0.79 | MAPT (0.51) | MAPTTSHRHSD17B10TLR8CNR1 | |
| SCHEMBL2088776 | 0.79 | MAPT (0.35) | ALDH1A1HPGDMAPT | |
| SCHEMBL971316 | 0.77 | HTR2A (0.37) | KDM4EALDH1A1GAAMAPTTSHR |
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-109111415-A | A kind of dendrobium nobile alcaloid-derivatives, preparation method and medical usage | 安徽中医药大学 | 2019-01-01 | — | — | CN | disclosed |