Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL687466 | 0.94 | SIGMAR1 (0.40) | SIGMAR1OPRM1OPRD1OPRK1CHRM5 | |
| SCHEMBL2110264 | 0.91 | SIGMAR1 (0.42) | SIGMAR1OPRM1OPRD1CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7970534 | 0.89 | SIGMAR1 (0.41) | SIGMAR1OPRM1OPRD1CHRM5CHRM3 | |
| Tetradecane SCHEMBL27779239 | 0.84 | SIGMAR1 (0.39) | SIGMAR1CHRM5CHRM3SLC6A2SLC6A4 | |
| SCHEMBL3898658 | 0.82 | ALDH1A1 (0.43) | SLC6A2ALDH1A1KMT2ALMNAMAPT | |
| SCHEMBL4089646 | 0.82 | ALDH1A1 (0.43) | SLC6A2ALDH1A1KMT2ALMNAMAPT | |
| SCHEMBL28201107 | 0.82 | ALDH1A1 (0.43) | SLC6A2ALDH1A1KMT2ALMNAMAPT | |
| SCHEMBL2961890 | 0.80 | ALDH1A1 (0.42) | SLC6A2SLC6A4ALDH1A1KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL25423101 | 0.80 | SIGMAR1 (0.43) | SIGMAR1OPRM1OPRD1OPRK1CHRM5 | |
| SCHEMBL6129180 | 0.78 | ALDH1A1 (0.46) | ALDH1A1KMT2ALMNAMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2109632-A2 | MATERIAL COMPRISING POLYAZACYCLOALKANES GRAFTED ONTO POLYPROPYLENE FIBRES METHOD FOR PRODUCTION THEREOF AND METHOD FOR REMOVAL OF METAL CATIONS FROM A LIQUID | Commissariat à l'Energie Atomique (FR) | 2009-10-21 | — | — | EP | disclosed |
| WO-2008099114-A2 | MATERIAL COMPRISING POLYAZACYCLOALKANES GRAFTED ONTO POLYPROPYLENE FIBRES METHOD FOR PRODUCTION THEREOF AND METHOD FOR REMOVAL OF METAL CATIONS FROM A LIQUID | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2008-08-21 | — | — | WO | disclosed |