Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | BRD4 | O60885 | 1/20 | 0.58 |
| ▸ | BDKRB1 | P46663 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22275075 | 1.00 | HSD17B10 (0.63) | HSD17B10KDM4EALDH1A1BRD4BDKRB1 | |
| SCHEMBL5259346 | 0.82 | BRD4 (0.66) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL13818079 | 0.82 | BRD4 (0.66) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL8692725 | 0.78 | BRD4 (0.58) | KDM4EALDH1A1BRD4KMT2AMEN1 | |
| SCHEMBL28751799 | 0.78 | BRD4 (0.56) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL1894761 | 0.78 | L3MBTL1 (0.58) | HSD17B10KDM4EALDH1A1BRD4L3MBTL1 | |
| SCHEMBL1169159 | 0.77 | BRD4 (0.56) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL29694632 | 0.77 | BRD4 (0.76) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL1991248 | 0.77 | BRD4 (0.76) | HSD17B10KDM4EALDH1A1BRD4KMT2A | |
| SCHEMBL31488397 | 0.77 | HSD17B10 (1.00) | HSD17B10KDM4EALDH1A1BDKRB1KMT2A |
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-111471059-B | PDE9 inhibitors and uses thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-02 | — | — | CN | disclosed |