Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL22112248 | 0.63 | ESR2 (0.45) | — | |
| SCHEMBL14336997 | 0.63 | MAT2A (0.45) | — | |
| SCHEMBL5239393 | 0.63 | MAT2A (0.45) | — | |
| SCHEMBL148293 | 0.63 | DRD3 (0.54) | SLC6A4 | |
| SCHEMBL3392335 | 0.62 | PTGDR2 (0.36) | SLC6A4PTGDR2MCHR1 | |
| SCHEMBL20095965 | 0.62 | HTR1A (0.55) | SLC6A4 | |
| SCHEMBL20095825 | 0.62 | HTR1A (0.55) | SLC6A4 | |
| SCHEMBL14336850 | 0.61 | SLC6A4 (0.53) | SLC6A4 | |
| SCHEMBL14431404 | 0.61 | SLC6A4 (0.45) | SLC6A4 | |
| SCHEMBL5198483 | 0.61 | SLC6A4 (0.53) | SLC6A4 |
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-2020120606-A1 | NEW PYRROLIDINE-2-CARBOXYLIC ACID DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS | ESTEVE PHARMACEUTICALS, S.A. (ES) | 2020-06-18 | — | — | WO | disclosed |