Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 16/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31140751 | 1.00 | NR3C1 (0.42) | NR3C1CYP1A2HTR2CPIK3CAMTOR | |
| SCHEMBL25233592 | 0.87 | NR3C1 (0.43) | NR3C1HTR2CPIK3CAMTOR | |
| SCHEMBL31140665 | 0.87 | NR3C1 (0.43) | NR3C1HTR2CPIK3CAMTOR | |
| SCHEMBL25245712 | 0.86 | NR3C1 (0.40) | NR3C1HTR2CPIK3CAMTOR | |
| SCHEMBL31140653 | 0.86 | NR3C1 (0.40) | NR3C1HTR2CPIK3CAMTOR | |
| SCHEMBL20536558 | 0.83 | NR3C1 (0.39) | NR3C1 | |
| SCHEMBL17546011 | 0.82 | MGLL (0.44) | NR3C1 | |
| SCHEMBL23885083 | 0.77 | FPR2 (0.43) | NR3C1 | |
| SCHEMBL21772867 | 0.76 | DGAT1 (0.39) | NR3C1 | |
| SCHEMBL29825100 | 0.76 | DGAT1 (0.39) | NR3C1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023116779-A1 | DIALKYNE COMPOUND AND USE THEREOF | 上海艾力斯医药科技股份有限公司 | 2023-06-29 | — | — | WO | disclosed |
| WO-2023116779-A1 | DIALKYNE COMPOUND AND USE THEREOF | 上海艾力斯医药科技股份有限公司 | 2023-06-29 | — | — | WO | disclosed |