Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL28948658 | 0.94 | KDM4E (0.42) | KDM4EALDH1A1HSD17B10TP53NPC1 | |
| SCHEMBL28819721 | 0.94 | KDM4E (0.42) | KDM4EALDH1A1HSD17B10TP53NPC1 | |
| SCHEMBL28819551 | 0.93 | KDM4E (0.41) | KDM4EALDH1A1HSD17B10TP53NPC1 | |
| SCHEMBL28819631 | 0.89 | CNR2 (0.45) | KDM4EALDH1A1TP53NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL4213341 | 0.87 | CNR2 (0.49) | KDM4EALDH1A1HSD17B10TP53NPC1 | |
| SCHEMBL28819625 | 0.87 | OPRM1 (0.41) | KDM4EALDH1A1TP53NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL4216436 | 0.87 | MCHR1 (0.46) | ALDH1A1TP53MAPT | |
| SCHEMBL28819754 | 0.86 | BRD4 (0.41) | RAB9AUSP2 | |
| Hydrochloric Acid SCHEMBL4213337 | 0.86 | CNR2 (0.48) | KDM4EALDH1A1HSD17B10TP53NPC1 | |
| SCHEMBL16569242 | 0.86 | HDAC1 (0.44) | TP53MAPTKMT2ANPSR1 |
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-110404073-B | Methods and pharmaceutical compositions for treating hepatitis B virus infection | 国家医疗保健研究所 | 2022-08-16 | — | — | CN | disclosed |