Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 7/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL3176297 | 0.97 | SLC18A3 (0.61) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL42580 | 0.97 | SLC18A3 (0.61) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL42833 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL11562787 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL790829 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8036483 | 0.94 | SLC18A3 (0.58) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL19262690 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| Hydrogen Peroxide SCHEMBL2352938 | 0.94 | SLC18A3 (0.58) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL19198566 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL447032 | 0.94 | SLC18A3 (0.63) | SLC18A3SIGMAR1CYP2D6TSHRSMN1; SMN2 |
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-3055293-B1 | DIARYLALKYLAMINE REV-ERB ANTAGONISTS AND THEIR USE AS MEDICAMENTS | FOND ST ITALIANO TECNOLOGIA (IT) | 2017-12-06 | — | — | EP | disclosed |