Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | DRD1 | P21728 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 4/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | HTR2B | P41595 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29208105 | 0.88 | HTR2A (0.52) | MEN1HTR1AKMT2AKCNH2DRD2 | |
| SCHEMBL29280905 | 0.82 | HTR2A (0.57) | HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL29280936 | 0.82 | MEN1 (0.59) | MEN1CHRM2HTR1AADRA2ADRD1 | |
| SCHEMBL11623591 | 0.77 | MEN1 (0.69) | MEN1CHRM2HTR1AADRA2ADRD1 | |
| SCHEMBL9053418 | 0.77 | CCR3 (0.65) | — | |
| SCHEMBL7350313 | 0.75 | ALDH1A1 (0.68) | MEN1CHRM2HTR1AADRA2ADRD1 | |
| SCHEMBL11755100 | 0.74 | ALDH1A1 (0.71) | MEN1CHRM2HTR1AADRA1AKMT2A | |
| SCHEMBL9339578 | 0.73 | MEN1 (0.51) | MEN1CHRM2HTR1AADRA2ADRD1 | |
| SCHEMBL30840002 | 0.73 | KCNH2 (0.51) | MEN1CHRM2HTR1AADRA2ADRD1 | |
| SCHEMBL11415059 | 0.73 | MEN1 (0.76) | MEN1CHRM2HTR1AADRA2ADRD1 |
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-117820199-A | Amide compound and application thereof in preparation of Sigma2 and 5HT2A inhibitors | 瀚远医药有限公司 | 2024-04-05 | — | — | CN | disclosed |