Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 11/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.35 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Dodecanoate SCHEMBL29052356 | 0.81 | GPR84 (0.53) | — | |
| Fumaric Acid SCHEMBL7491655 | 0.80 | KDM4E (0.38) | SIGMAR1CHRM5CHRM3OPRD1 | |
| Fumaric Acid SCHEMBL7491648 | 0.80 | KDM4E (0.38) | SIGMAR1CHRM5CHRM3OPRD1 | |
| SCHEMBL5387 | 0.80 | — | — | |
| SCHEMBL77101 | 0.80 | — | — | |
| SCHEMBL1706403 | 0.80 | MEN1 (0.39) | SIGMAR1CHRM5CHRM3OPRD1SLC6A2 | |
| Acetamide SCHEMBL4168128 | 0.79 | OPRD1 (0.39) | SIGMAR1CHRM5CHRM3OPRD1SLC6A4 | |
| Benzene SCHEMBL27485207 | 0.78 | MEN1 (0.50) | SIGMAR1OPRD1SLC6A2SLC6A4 | |
| SCHEMBL13509549 | 0.78 | MEN1 (0.38) | SIGMAR1CHRM5CHRM3SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL522550 | 0.78 | MEN1 (0.38) | SIGMAR1CHRM5CHRM3SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103857440-B | Antimycotic and antibacterium prodrug based on conjugate | 维奥姆生物科学有限公司 | 2018-09-25 | — | — | CN | disclosed |