Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 10/20 | 0.59 |
| ▸ | NOTUM | Q6P988 | 6/20 | 0.51 |
| ▸ | BRD4 | O60885 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22605561 | 0.90 | GPBAR1 (0.50) | GPBAR1NOTUMBRD4CYP2D6CYP2C9 | |
| SCHEMBL27988819 | 0.86 | GPBAR1 (0.54) | GPBAR1 | |
| Hydrochloric Acid SCHEMBL27988803 | 0.85 | GPBAR1 (0.53) | GPBAR1 | |
| SCHEMBL22588234 | 0.82 | GPR119 (0.50) | GPBAR1 | |
| Trifluoroacetic Acid SCHEMBL22587774 | 0.82 | GPBAR1 (0.44) | GPBAR1NOTUMBRD4 | |
| SCHEMBL15060098 | 0.81 | GPBAR1 (0.51) | GPBAR1 | |
| SCHEMBL27988483 | 0.81 | GPBAR1 (0.56) | GPBAR1 | |
| SCHEMBL16738472 | 0.80 | GPBAR1 (0.51) | GPBAR1 | |
| SCHEMBL16738524 | 0.78 | GPBAR1 (0.49) | GPBAR1 | |
| SCHEMBL15933960 | 0.78 | GPBAR1 (0.48) | GPBAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014117292-A1 | AMIDE COMPOUNDS AND PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | 中国科学院上海药物研究所 (CN) | 2014-08-07 | — | — | WO | disclosed |