Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A2 | O15244 | 8/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.56 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL24521733 | 0.87 | SLC22A2 (0.61) | SLC22A2CYP3A4TMEM97ABCG2 | |
| SCHEMBL30991652 | 0.85 | SLC22A2 (0.63) | SLC22A2CYP3A4TMEM97ABCG2 | |
| SCHEMBL17265186 | 0.80 | SLC22A2 (0.54) | SLC22A2CYP3A4TMEM97ABCG2 | |
| SCHEMBL22482727 | 0.79 | SLC22A2 (0.57) | SLC22A2CYP3A4TMEM97ABCG2 | |
| SCHEMBL10283865 | 0.79 | SLC22A2 (0.60) | SLC22A2CYP3A4TMEM97ABCG2 | |
| SCHEMBL15928664 | 0.79 | — | — | |
| SCHEMBL15928579 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL15914594 | 0.79 | — | — | |
| SCHEMBL24799344 | 0.78 | SLC22A2 (0.51) | SLC22A2 | |
| SCHEMBL82019 | 0.77 | SLC22A2 (0.69) | SLC22A2CYP3A4TMEM97ABCG2 |
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-2940019-B1 | SUBSTITUTED SPIROPYRIDO[1,2-a]PYRAZINE DERIVATIVE AND MEDICINAL USE THEREOF AS HIV INTEGRASE INHIBITOR | JAPAN TOBACCO INC (JP) | 2018-03-28 | — | — | EP | disclosed |