Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.42 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.40 |
| ▸ | CALCA | P06881 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13993853 | 0.90 | TRPV1 (0.42) | TLR2ADORA2ATRPV1PDE10ACALCA | |
| SCHEMBL13812898 | 0.77 | CALCA (0.41) | TLR2CALCAALDH1A1LMNAL3MBTL1 | |
| SCHEMBL4071013 | 0.75 | ADORA2A (0.50) | ADORA2ATAS1R3TAS1R1TAS1R2RIPK1 | |
| SCHEMBL13993858 | 0.74 | CALCA (0.62) | ADORA2ACALCA | |
| SCHEMBL17768922 | 0.74 | ADORA2A (0.43) | ADORA2ATRPV1PDE10A | |
| SCHEMBL6504246 | 0.72 | CALCA (0.60) | CALCA | |
| SCHEMBL4060243 | 0.71 | TAS1R3 (0.49) | ADORA2ATAS1R3TAS1R1TAS1R2ALDH1A1 | |
| SCHEMBL4066910 | 0.71 | TAS1R3 (0.49) | ADORA2ATAS1R3TAS1R1TAS1R2ALDH1A1 | |
| SCHEMBL599644 | 0.69 | CA12 (0.63) | TRPV1PDE10ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL31452698 | 0.67 | PDE10A (0.56) | TRPV1PDE10ATAS1R3TAS1R1TAS1R2 |
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-1664046-B1 | AZA-QUINOLINOL PHOSPHONATE INTEGRASE INHIBITOR COMPOUNDS | GILEAD SCIENCES INC (US) | 2009-06-17 | — | — | EP | disclosed |