Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.64 |
| ▸ | DRD2 | P14416 | 6/20 | 0.64 |
| ▸ | HTR2A | P28223 | 6/20 | 0.64 |
| ▸ | HTR2C | P28335 | 2/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.58 |
| ▸ | HRH1 | P35367 | 2/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | DRD1 | P21728 | 1/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
| ▸ | DRD5 | P21918 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.58 |
| ▸ | HTR1D | P28221 | 1/20 | 0.58 |
| ▸ | HTR1B | P28222 | 1/20 | 0.58 |
| ▸ | HTR1E | P28566 | 1/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL19549054 | 0.90 | HTR1A (0.68) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL29433200 | 0.90 | HTR1A (0.68) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL29242379 | 0.89 | HTR1A (0.62) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL30901141 | 0.86 | HTR1A (0.59) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL29242356 | 0.86 | HTR1A (0.59) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL17765537 | 0.85 | HTR1A (0.54) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL20021850 | 0.84 | HTR1A (0.61) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL16443220 | 0.83 | HTR1A (0.65) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL16443221 | 0.83 | HTR1A (0.65) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL16442962 | 0.83 | HTR1A (0.62) | HTR1ADRD2HTR2AHTR2CADRA1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114166960-B | Method for detecting substances related to epipiprazole | 西安远大科创医药科技有限公司 | 2023-09-29 | — | — | CN | claimed |
| CN-114166960-A | Detection method of brexpiprazole related substance | 西安远大科创医药科技有限公司 | 2022-03-11 | — | — | CN | claimed |
| CN-114166960-B | Method for detecting substances related to epipiprazole | 西安远大科创医药科技有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-114166960-A | Detection method of brexpiprazole related substance | 西安远大科创医药科技有限公司 | 2022-03-11 | — | — | CN | disclosed |