Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL245283 | 0.85 | PSIP1 (0.49) | PSIP1CYP3A4 | |
| SCHEMBL243700 | 0.82 | PSIP1 (0.50) | PSIP1CYP3A4 | |
| SCHEMBL244914 | 0.81 | PSIP1 (0.51) | PSIP1CYP3A4 | |
| SCHEMBL244717 | 0.81 | PSIP1 (0.51) | PSIP1CYP3A4 | |
| SCHEMBL3326843 | 0.80 | PSIP1 (0.44) | PSIP1CYP3A4 | |
| SCHEMBL3304151 | 0.79 | PSIP1 (0.48) | PSIP1CYP3A4 | |
| SCHEMBL20021142 | 0.79 | PSIP1 (0.42) | PSIP1CYP3A4 | |
| SCHEMBL243122 | 0.79 | PSIP1 (0.49) | PSIP1CYP3A4 | |
| SCHEMBL244312 | 0.79 | PSIP1 (0.49) | PSIP1CYP3A4 | |
| SCHEMBL20021147 | 0.79 | PSIP1 (0.49) | PSIP1CYP3A4 |
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-2012003498-A1 | 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-01-05 | — | — | WO | disclosed |