Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CRHBP | P24387 | 2/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30818440 | 0.85 | SIGMAR1 (0.58) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL25240475 | 0.81 | SIGMAR1 (0.54) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL28370856 | 0.79 | CYP11B1 (0.39) | SIGMAR1ADRA2A | |
| SCHEMBL11700217 | 0.79 | SIGMAR1 (0.53) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL11703956 | 0.78 | SIGMAR1 (0.51) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL31541237 | 0.77 | ESR2 (0.38) | DRD2 | |
| SCHEMBL1793089 | 0.76 | HTR2C (0.52) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL19289612 | 0.74 | SIGMAR1 (0.61) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL6687949 | 0.73 | SIGMAR1 (0.40) | SIGMAR1ADRA2AHTR2CDRD2HTR2A | |
| SCHEMBL11703132 | 0.73 | SIGMAR1 (0.47) | SIGMAR1ADRA2AHTR2CDRD2HTR2A |
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-114907389-A | Boronic acid derivatives | 首药控股(北京)股份有限公司 | 2022-08-16 | — | — | CN | disclosed |