Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12533599 | 0.88 | PSIP1 (0.33) | PSIP1 | |
| SCHEMBL14405278 | 0.88 | PSIP1 (0.33) | PSIP1 | |
| SCHEMBL12533451 | 0.88 | PSIP1 (0.41) | PSIP1CYP3A4KCNH2NR1I2SLCO1B1 | |
| SCHEMBL12551893 | 0.79 | PSIP1 (0.40) | PSIP1CYP3A4KCNH2NR1I2 | |
| SCHEMBL12551898 | 0.79 | CYP3A4 (0.41) | PSIP1CYP3A4KCNH2NR1I2SLCO1B1 | |
| SCHEMBL12533751 | 0.77 | PSIP1 (0.40) | PSIP1CYP3A4KCNH2NR1I2 | |
| SCHEMBL12533452 | 0.76 | PSIP1 (0.32) | PSIP1 | |
| SCHEMBL12533466 | 0.76 | PSIP1 (0.32) | PSIP1 | |
| SCHEMBL12533605 | 0.75 | PSIP1 (0.39) | PSIP1CYP3A4KCNH2NR1I2SLCO1B1 | |
| SCHEMBL14405288 | 0.75 | PSIP1 (0.39) | PSIP1CYP3A4KCNH2NR1I2 |
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-2220095-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | GILEAD SCIENCES INC (US) | 2013-01-02 | — | — | EP | disclosed |