Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 5/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.30 |
| ▸ | HTR2B | P41595 | 2/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1E | P28566 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28820106 | 1.00 | TDP1 (0.41) | TDP1HTR2ANOS3NOS1NOS2 | |
| Tert-Butyl Formate SCHEMBL27953720 | 0.83 | TDP1 (0.50) | TDP1 | |
| SCHEMBL879371 | 0.79 | — | — | |
| SCHEMBL15395714 | 0.79 | — | — | |
| SCHEMBL249249 | 0.79 | — | — | |
| Tert-Butyl Formate SCHEMBL28787826 | 0.79 | TDP1 (0.45) | TDP1HTR2A | |
| Tert-Butyl Formate SCHEMBL28787831 | 0.79 | TDP1 (0.45) | TDP1HTR2A | |
| Tert-Butyl Formate SCHEMBL17956841 | 0.78 | TDP1 (0.43) | TDP1HTR2A | |
| Tert-Butyl Formate SCHEMBL17956842 | 0.78 | TDP1 (0.43) | TDP1HTR2A | |
| Tert-Butyl Formate SCHEMBL26094336 | 0.78 | TDP1 (0.43) | TDP1HTR2ANOS2 |
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-104822658-A | Fused Tricyclic Amides as Multiple Kinase Inhibitors | BEIGENE LTD | 2015-08-05 | — | — | CN | disclosed |