Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 7/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | SCN11A | Q9UI33 | 1/20 | 0.34 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30121551 | 0.84 | GBA1 (0.39) | CHRM5ADRA2COPRL1OPRM1OPRK1 | |
| SCHEMBL24480651 | 0.81 | NCF1 (0.38) | CHRM5ADRA2COPRL1OPRM1OPRK1 | |
| SCHEMBL25856125 | 0.79 | TSHR (0.37) | CHRM5ADRA2CTSHR | |
| SCHEMBL27268967 | 0.76 | SIGMAR1 (0.32) | TSHRSIGMAR1 | |
| SCHEMBL27291380 | 0.76 | SIGMAR1 (0.32) | TSHRSIGMAR1 | |
| SCHEMBL25571573 | 0.75 | TSHR (0.38) | TSHR | |
| SCHEMBL3811970 | 0.74 | CHRM5 (0.56) | CHRM5ADRA2COPRL1OPRM1OPRK1 | |
| SCHEMBL3811966 | 0.74 | CHRM5 (0.56) | CHRM5ADRA2COPRL1OPRM1OPRK1 | |
| SCHEMBL2681656 | 0.74 | CHRM5 (0.62) | CHRM5ADRA2COPRL1OPRM1OPRK1 | |
| SCHEMBL861534 | 0.74 | CHRM5 (0.62) | CHRM5ADRA2COPRL1OPRM1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022253309-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS AND APPLICATION THEREOF | 首药控股(北京)股份有限公司 | 2022-12-08 | — | — | WO | disclosed |