Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11771106 | 0.95 | GAA (0.47) | GAAKDM4ENOX1MAPTCYP3A4 | |
| SCHEMBL11773006 | 0.88 | GAA (0.40) | GAAKDM4ENOX1MAPTCYP3A4 | |
| SCHEMBL32665834 | 0.77 | ITGB2 (0.47) | MAPTCYP3A4ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL29293252 | 0.75 | HPGD (0.38) | GAAKDM4ENOX1MAPTCYP3A4 | |
| SCHEMBL19312375 | 0.72 | CYP3A4 (0.36) | GAANOX1MAPTCYP3A4POLB | |
| SCHEMBL11163826 | 0.70 | CYP3A4 (0.46) | GAANOX1MAPTCYP3A4POLB | |
| SCHEMBL9476344 | 0.69 | CYP3A4 (0.48) | GAANOX1MAPTCYP3A4POLB | |
| SCHEMBL14919249 | 0.69 | MAPT (0.41) | GAAMAPTCYP3A4POLBALDH1A1 | |
| Trimethylammonium SCHEMBL11775962 | 0.68 | TSHR (0.44) | GAAKDM4ENOX1POLBALDH1A1 | |
| SCHEMBL31396637 | 0.68 | CCR2 (0.44) | KDM4ENOX1MAPTCYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3933851-A | Preparation of aromatic 2-imino-1,3-dithietanes | AMERICAN CYANAMID COMPANY (US) | 1976-01-20 | — | — | US | disclosed |