Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH4 | P08319 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2555396 | 0.77 | GNAO1 (0.34) | — | |
| SCHEMBL18666615 | 0.77 | LTA4H (0.37) | ACHE | |
| SCHEMBL24146232 | 0.76 | CYP1A2 (0.42) | CHRM5ADRA2CACHECYP1A2 | |
| SCHEMBL29956822 | 0.75 | HRH3 (0.48) | SMN1; SMN2CYP1A2 | |
| SCHEMBL947690 | 0.75 | HRH3 (0.48) | SMN1; SMN2CYP1A2 | |
| SCHEMBL5807819 | 0.75 | HRH3 (0.48) | SMN1; SMN2CYP1A2 | |
| SCHEMBL8186300 | 0.75 | SMN1; SMN2 (0.39) | SMN1; SMN2 | |
| SCHEMBL18286778 | 0.75 | ALOX15 (0.48) | CHRM5ADRA2CACHENPC1CYP1A2 | |
| SCHEMBL28750905 | 0.75 | CHRM5 (0.40) | CHRM5ADRA2CACHESMN1; SMN2OPRM1 | |
| SCHEMBL7738333 | 0.75 | ACHE (0.44) | CHRM5ADRA2CACHESMN1; SMN2CYP1A2 |
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-4019089-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE 1, 4-BENZOTHIAZEPINE-1-OXIDE DERIVATIVE | Aetas Pharma Co. Ltd. (JP) | 2022-06-29 | — | — | EP | disclosed |