Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 17/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 13/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20289355 | 0.85 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL19700743 | 0.75 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL27976772 | 0.75 | CYP2D6 (0.61) | SLC6A4SLC6A2CYP2D6 | |
| SCHEMBL30330276 | 0.71 | CYP2D6 (0.57) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8472276 | 0.71 | SLC6A2 (0.62) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL27984478 | 0.70 | MEN1 (0.72) | SLC6A4SLC6A2CYP2D6 | |
| SCHEMBL23679916 | 0.67 | CHRM2 (0.50) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL27791354 | 0.67 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL15962306 | 0.67 | SLC6A4 (0.57) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL10413788 | 0.66 | SLC6A4 (0.69) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 |
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-2018111707-A1 | 7-PHENYLETHYLAMINO-4H-PYRIMIDO[4,5-D][1,3]OXAZIN-2-ONE COMPOUNDS AS MUTANT IDH1 AND IDH2 INHIBITORS | ELI LILLY AND COMPANY (US) | 2018-06-21 | — | — | WO | disclosed |