Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 13/20 | 0.40 |
| ▸ | CASP1 | P29466 | 5/20 | 0.39 |
| ▸ | CASP8 | Q14790 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4491434 | 0.78 | SRC (0.42) | SRCCASP1CASP8 | |
| SCHEMBL5464440 | 0.74 | — | — | |
| SCHEMBL14170742 | 0.73 | SRC (0.34) | SRCCASP1CASP8 | |
| SCHEMBL4501161 | 0.73 | SRC (0.49) | SRCCASP1CASP8 | |
| SCHEMBL7428585 | 0.73 | CASP1 (0.43) | SRCCASP1CASP8 | |
| SCHEMBL5217351 | 0.70 | SRC (0.48) | SRCCASP1CASP8 | |
| SCHEMBL4488508 | 0.69 | SRC (0.54) | SRC | |
| SCHEMBL4484988 | 0.69 | SRC (0.55) | SRCCASP1CASP8 | |
| SCHEMBL5903395 | 0.69 | SRC (0.42) | SRCCASP1CASP8 | |
| SCHEMBL10833244 | 0.69 | F2 (0.42) | SRCCASP1CASP8 |
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 |
|---|---|---|---|---|---|---|---|
| US-7550453-B2 | Anticancer agents; colon cancer or hepatocellular carcinoma; analogs of bengamide where the caprolactam ring is changed and/or substituted e.g. N-(2-Methyl-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepin-4-yl)-(E)-(2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnon-6-enamide | AVENTIS PHARMA SA (FR) | 2009-06-23 | — | — | US | disclosed |