Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | ATAD2 | Q6PL18 | 2/20 | 0.44 |
| ▸ | S100B | P04271 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 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 | |
|---|---|---|---|---|
| SCHEMBL25407471 | 1.00 | HSD17B10 (0.62) | HSD17B10HPGDHTTATAD2S100B | |
| SCHEMBL30349771 | 0.84 | KDM4E (0.49) | HSD17B10HPGDHTTADORA2BADORA2A | |
| SCHEMBL25407320 | 0.84 | HSD17B10 (0.46) | HSD17B10HPGDHTTADORA2BLMNA | |
| SCHEMBL25406772 | 0.84 | KDM4E (0.49) | HSD17B10HPGDHTTADORA2BADORA2A | |
| SCHEMBL30349777 | 0.83 | ADORA2B (0.47) | HSD17B10HPGDHTTATAD2S100B | |
| SCHEMBL30349667 | 0.83 | ADORA2A (0.47) | HSD17B10HPGDHTTATAD2ADORA2B | |
| SCHEMBL25408350 | 0.83 | ADORA2B (0.47) | HSD17B10HPGDHTTATAD2S100B | |
| SCHEMBL25407897 | 0.83 | ADORA2A (0.47) | HSD17B10HPGDHTTATAD2ADORA2B | |
| SCHEMBL25408215 | 0.83 | HSD17B10 (0.45) | HSD17B10HPGDHTT | |
| SCHEMBL30349687 | 0.83 | HSD17B10 (0.45) | HSD17B10HPGDHTT |
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-115867277-A | Novel fused heterocyclyl-carbohydrazone acyldinitrile compounds and use thereof | 韩国科学技术研究院 | 2023-03-28 | — | — | CN | disclosed |