Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 6/20 | 0.39 |
| ▸ | GRM5 | P41594 | 4/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ITGA5 | P08648 | 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 | |
|---|---|---|---|---|
| SCHEMBL16754328 | 1.00 | NTRK1 (0.39) | NTRK1GRM5ACKR3PDE4BPDE4D | |
| SCHEMBL22239713 | 0.95 | NTRK1 (0.41) | NTRK1GRM5ACKR3 | |
| SCHEMBL16754440 | 0.95 | NTRK1 (0.41) | NTRK1GRM5ACKR3 | |
| SCHEMBL16754448 | 0.94 | DRD2 (0.39) | NTRK1GRM5DRD2DRD4DRD3 | |
| SCHEMBL22239709 | 0.94 | DRD2 (0.39) | NTRK1GRM5DRD2DRD4DRD3 | |
| SCHEMBL19714365 | 0.92 | ALDH1A1 (0.42) | GRM5DRD2DRD4DRD3 | |
| SCHEMBL17777053 | 0.92 | GRM5 (0.42) | GRM5DRD2DRD4DRD3BTK | |
| SCHEMBL16754631 | 0.92 | GRM5 (0.42) | GRM5DRD2DRD4DRD3BTK | |
| SCHEMBL19714249 | 0.91 | MAPT (0.43) | GRM5DRD2DRD4DRD3 | |
| SCHEMBL17777066 | 0.90 | NTRK1 (0.40) | NTRK1GRM5ACKR3CNR2 |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |