Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | SCN1A | P35498 | 3/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7800154 | 0.88 | ALDH1A1 (0.41) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL17305906 | 0.83 | SLC6A2 (0.46) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL293762 | 0.83 | TAAR1 (0.43) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL431888 | 0.81 | SCN1A (0.41) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL2701953 | 0.81 | HTT (0.42) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL97126 | 0.79 | HCAR2 (0.41) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL29633537 | 0.79 | TRPA1 (0.44) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL584471 | 0.79 | ADRA2A (0.42) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL19368242 | 0.79 | HPGD (0.41) | TAAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL97127 | 0.79 | TRPA1 (0.44) | SCN1ASCN2ASCN3ALMNAHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5076829-A | SUBSTITUTED 2,3-EPOXY-5-CYCLOHEXENONE DERIVATIVES, AND FUNGICIDES AND HERBICIDES CONTAINING SAME | BASF AKTIENGESELLSCHAFT (DE) | 1991-12-31 | — | — | US | disclosed |
| EP-0282792-B1 | SUBSTITUTED 2,3-EPOXY-5-CYCLOHEXENONE DERIVATIVES AND FUNGICIDES AND HERBICIDES CONTAINING THEM | BASF Aktiengesellschaft (DE) | 1990-05-30 | — | — | EP | disclosed |
| EP-0282792-A1 | Substituted 2,3-epoxy-5-cyclohexenone derivatives and fungicides and herbicides containing them | BASF Aktiengesellschaft (DE) | 1988-09-21 | — | — | EP | disclosed |