Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | F13A1 | P00488 | 1/20 | 0.30 |
| ▸ | TGM2 | P21980 | 1/20 | 0.30 |
| ▸ | TGM1 | P22735 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11300539 | 0.70 | SLC6A4 (0.40) | OPRD1ALDH1A1 | |
| SCHEMBL4364895 | 0.69 | CHRM5 (0.50) | CHRM5CHRM3CA12CA1CA2 | |
| SCHEMBL21056052 | 0.67 | MEN1 (0.31) | — | |
| SCHEMBL1426567 | 0.67 | OPRD1 (0.35) | CHRM5CHRM3CA12CA1CA2 | |
| SCHEMBL1286434 | 0.67 | SIGMAR1 (0.40) | CHRM5CHRM3OPRD1SIGMAR1 | |
| SCHEMBL2577695 | 0.66 | MEN1 (0.33) | CA2 | |
| SCHEMBL1262907 | 0.66 | SLC6A2 (0.38) | CHRM5CHRM3OPRD1SIGMAR1 | |
| SCHEMBL27527324 | 0.66 | OPRD1 (0.37) | CHRM5CHRM3CA12CA1CA2 | |
| SCHEMBL21056048 | 0.66 | OPRD1 (0.36) | CHRM5CHRM3CA12CA1CA2 | |
| SCHEMBL27028957 | 0.65 | SIGMAR1 (0.35) | OPRD1SIGMAR1 |
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-106928150-B | Acrylamide aniline derivative and pharmaceutical application thereof | 恩瑞生物医药科技（上海）有限公司 | 2020-07-31 | — | — | CN | disclosed |