Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30139610 | 0.82 | TAAR1 (0.48) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL3412515 | 0.80 | OPRM1 (0.40) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL27270847 | 0.80 | CHRM2 (0.41) | OPRM1CHRM2OPRD1NR1I2ADORA3 | |
| SCHEMBL10688173 | 0.80 | KCNN4 (0.45) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL19858983 | 0.80 | KCNN4 (0.45) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL5802025 | 0.80 | KCNN4 (0.45) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL22538703 | 0.79 | KCNN4 (0.37) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| Hydrochloric Acid SCHEMBL11375334 | 0.78 | KCNN4 (0.43) | KCNN4OPRM1CHRM2OPRD1NR1I2 | |
| SCHEMBL9003672 | 0.77 | SIGMAR1 (0.48) | KCNN4OPRM1CHRM2KCNH2CHRM4 | |
| SCHEMBL9338305 | 0.77 | KMT2A (0.54) | OPRM1CHRM2OPRD1NR1I2ADORA3 |
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-104114560-B | The solid form of (1r, 4r) -6 '-fluoro- (N, N- dimethyl) -4- phenyl -4 ', the H- of 9 '-dihydro -3 ' spiral shells [hexamethylene -1,1 '-pyrans simultaneously [3,4, b] indoles] -4- amine and sulfuric acid | 格吕伦塔尔有限公司 | 2018-05-04 | — | — | CN | disclosed |