Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | P2RY6 | Q15077 | 2/20 | 0.32 |
| ▸ | P2RY14 | Q15391 | 2/20 | 0.32 |
| ▸ | NT5E | P21589 | 1/20 | 0.32 |
| ▸ | POLG | P54098 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.30 |
| ▸ | DCK | P27707 | 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 | |
|---|---|---|---|---|
| SCHEMBL19987148 | 0.89 | CYP3A4 (0.48) | CYP3A4CYP2C9P2RY6P2RY14NT5E | |
| SCHEMBL19987374 | 0.83 | NT5E (0.43) | NT5E | |
| SCHEMBL21511154 | 0.82 | CYP3A4 (0.50) | CYP3A4CYP2C9P2RY6P2RY14NT5E | |
| SCHEMBL19987320 | 0.82 | CYP3A4 (0.51) | CYP3A4CYP2C9P2RY6P2RY14 | |
| SCHEMBL19987286 | 0.81 | ST6GAL1 (0.36) | CYP3A4CYP2C9 | |
| SCHEMBL19987174 | 0.80 | CYP3A4 (0.45) | CYP3A4CYP2C9P2RY6P2RY14NT5E | |
| SCHEMBL19987177 | 0.79 | CYP3A4 (0.45) | CYP3A4CYP2C9P2RY6P2RY14NT5E | |
| SCHEMBL19987255 | 0.78 | CYP3A4 (0.52) | CYP3A4CYP2C9NT5E | |
| SCHEMBL21511228 | 0.78 | CYP3A4 (0.52) | CYP3A4CYP2C9NT5E | |
| SCHEMBL19987165 | 0.78 | CYP3A4 (0.52) | CYP3A4CYP2C9NT5E |
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-2018049535-A1 | NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF | LCB PHARMA INC. (CA) | 2018-03-22 | — | — | WO | disclosed |