Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 3/20 | 0.41 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | STAT5B | P51692 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3109868 | 0.90 | GLS (0.42) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL30616963 | 0.89 | HTR2C (0.40) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL24289750 | 0.89 | HTR2C (0.40) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL24288915 | 0.88 | GLS (0.40) | GLSHTR2CSLC6A4AKT1CTSL | |
| SCHEMBL3105107 | 0.88 | ADRB3 (0.41) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL3116212 | 0.85 | LTA4H (0.42) | GLSHTR2CSLC6A4AKT1CTSL | |
| SCHEMBL3115144 | 0.84 | CTSS (0.39) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL3122841 | 0.84 | GLS (0.43) | GLSHTR2CSLC6A4HDAC3HDAC1 | |
| SCHEMBL3108959 | 0.83 | NR1H4 (0.45) | GLSHTR2CSLC6A4CTSLCTSB | |
| SCHEMBL8169487 | 0.82 | GLS (0.38) | GLSHTR2CSLC6A4CTSLCTSB |
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-116583509-A | Compounds and methods for treating cancer | 上海睿跃生物科技有限公司 | 2023-08-11 | — | — | CN | disclosed |