Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 4/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12228571 | 0.91 | — | — | |
| SCHEMBL16870529 | 0.91 | GRIN2D (0.45) | KDM1AHTR2AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL30968744 | 0.91 | — | — | |
| SCHEMBL12279944 | 0.78 | RET (0.50) | SIGMAR1HTR2AGRIN1GRIN2B | |
| SCHEMBL29439854 | 0.76 | HTR2A (0.55) | SIGMAR1HTR2AHRH1GRIN1GRIN2B | |
| SCHEMBL14477617 | 0.76 | DRD2 (0.38) | SIGMAR1HTR2AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL14870745 | 0.76 | HTR2A (0.55) | SIGMAR1HTR2AHRH1GRIN1GRIN2B | |
| SCHEMBL270201 | 0.75 | KDM1A (0.40) | KDM1AGRIN2DGRIN3BGRIN1GRIN2A | |
| Cyclohexylamine SCHEMBL5849650 | 0.75 | KDM1A (0.42) | SIGMAR1KDM1A | |
| SCHEMBL5190442 | 0.74 | GRIN1 (0.40) | SIGMAR1KDM1AGRIN2DGRIN3BGRIN1 |
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-113230374-A | External formula for treating cold in uterus and preparation method and application thereof | 湖南省国方中医药科技有限公司 | 2021-08-10 | — | — | CN | disclosed |