Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | CTNNB1 | P35222 | 5/20 | 0.42 |
| ▸ | WNT3A | P56704 | 5/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13365170 | 0.84 | SLC6A2 (0.45) | SLC6A2SLC6A4CTNNB1WNT3AHTR1B | |
| SCHEMBL1465387 | 0.82 | SLC6A2 (0.43) | SLC6A2SLC6A4CTNNB1WNT3AHTR1B | |
| SCHEMBL17656394 | 0.75 | MEN1 (0.46) | CTNNB1WNT3ATAS1R3TAS1R1DRD3 | |
| SCHEMBL14457555 | 0.72 | DRD3 (0.44) | CA2DRD3 | |
| SCHEMBL15069387 | 0.72 | SLC6A2 (0.43) | SLC6A2SLC6A4CTNNB1WNT3AHTR1B | |
| SCHEMBL14403866 | 0.71 | SLC6A2 (0.49) | SLC6A2SLC6A4CTNNB1WNT3A | |
| SCHEMBL19753148 | 0.71 | MAPK14 (0.38) | DRD3 | |
| SCHEMBL24825898 | 0.71 | SLC6A4 (0.41) | SLC6A2SLC6A4CTNNB1WNT3AHTR1B | |
| SCHEMBL10203616 | 0.71 | CFTR (0.50) | SLC6A2SLC6A4 | |
| SCHEMBL27511149 | 0.71 | OPRM1 (0.51) | SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2674428-B1 | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2016-04-06 | — | — | EP | disclosed |