Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.61 |
| ▸ | HTR1A | P08908 | 7/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 6/20 | 0.61 |
| ▸ | MAPT | P10636 | 6/20 | 0.61 |
| ▸ | DRD2 | P14416 | 6/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.61 |
| ▸ | DRD1 | P21728 | 5/20 | 0.61 |
| ▸ | DRD3 | P35462 | 5/20 | 0.61 |
| ▸ | HTR2A | P28223 | 5/20 | 0.61 |
| ▸ | HRH1 | P35367 | 5/20 | 0.61 |
| ▸ | HTR6 | P50406 | 5/20 | 0.61 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.61 |
| ▸ | SLC22A1 | O15245 | 4/20 | 0.61 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.61 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL30718485 | 1.00 | SIGMAR1 (0.67) | SIGMAR1CYP2D6HTR1ACYP1A2SLC6A4 | |
| SCHEMBL30718464 | 0.89 | KDM1A (0.59) | SIGMAR1CYP2D6HTR1ACYP1A2SLC6A4 | |
| SCHEMBL29277400 | 0.89 | KDM1A (0.59) | SIGMAR1CYP2D6HTR1ACYP1A2SLC6A4 | |
| SCHEMBL9419633 | 0.83 | PIM1 (0.71) | SIGMAR1CYP2D6HTR1ACYP1A2SLC6A4 | |
| SCHEMBL8211943 | 0.82 | KMT2A (0.59) | SIGMAR1CYP2D6HTR1ACYP1A2SLC6A4 | |
| SCHEMBL29875831 | 0.80 | SIGMAR1 (0.55) | SIGMAR1CYP2D6CYP1A2MAPTDRD2 | |
| SCHEMBL8666818 | 0.80 | SIGMAR1 (0.55) | SIGMAR1CYP2D6CYP1A2MAPTDRD2 | |
| SCHEMBL29759104 | 0.80 | SIGMAR1 (0.55) | SIGMAR1CYP2D6CYP1A2MAPTDRD2 | |
| SCHEMBL9419622 | 0.79 | PIM1 (0.78) | SIGMAR1HTR1ASLC6A4CHRM2DRD1 | |
| SCHEMBL5953850 | 0.79 | MEN1 (0.55) | SIGMAR1MAPTSMPD1ALDH1A1CNR1 |
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-117285481-A | Positive electrode active electrolyte based on phenoxazine quaternary ammonium salt and water system all-organic flow battery thereof | 常州大学 | 2023-12-26 | — | — | CN | disclosed |