Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 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 | |
|---|---|---|---|---|
| SCHEMBL7326841 | 0.91 | ALDH1A1 (0.38) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL7468842 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL7468837 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL9135165 | 0.68 | ALDH1A1 (0.52) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL10542195 | 0.68 | ALDH1A1 (0.36) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL9118903 | 0.67 | ALDH1A1 (0.55) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL9680281 | 0.67 | ALDH1A1 (0.55) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL698616 | 0.67 | TSHR (0.48) | ALDH1A1L3MBTL1TDP1MAPK1SLC6A2 | |
| SCHEMBL7288194 | 0.66 | ALDH1A1 (0.53) | ALDH1A1CHRM2CHRM5CHRM1CHRM3 | |
| SCHEMBL7387979 | 0.66 | CYP1A2 (0.43) | CHRM5CHRM1CHRM3MAPK1SLC6A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1990000399-A1 | RETROVIRAL PROTEASE BINDING PEPTIDES | SMITHKLINE BECKMAN CORPORATION (US) | 1990-01-25 | — | — | WO | disclosed |
| EP-0352000-A2 | Retroviral protease binding peptides | SMITHKLINE BEECHAM CORPORATION (US) | 1990-01-24 | — | — | EP | disclosed |