Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6362811 | 0.79 | HRH1 (0.42) | ALDH1A1MAPTHTR7CNR1DRD2 | |
| SCHEMBL7607969 | 0.78 | HTR7 (0.68) | ALDH1A1TP53HTR7DRD2DRD3 | |
| SCHEMBL31033173 | 0.78 | HTR7 (0.39) | ALDH1A1TP53SIGMAR1HTR7CA1 | |
| SCHEMBL4227794 | 0.77 | HTR2A (0.54) | ALDH1A1TP53SIGMAR1MAPTHTR7 | |
| SCHEMBL31033189 | 0.77 | DRD2 (0.64) | ALDH1A1TP53HTR7DRD2DRD3 | |
| SCHEMBL31033213 | 0.75 | DRD2 (0.56) | ALDH1A1TP53HTR7DRD2DRD3 | |
| SCHEMBL2674982 | 0.75 | DRD2 (0.66) | HTR7DRD2DRD3DRD4CHRM2 | |
| SCHEMBL31033195 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TP53SIGMAR1MAPTHTR7 | |
| SCHEMBL31033176 | 0.73 | ALDH1A1 (0.51) | ALDH1A1TP53SIGMAR1MAPTHTR7 | |
| SCHEMBL31033145 | 0.73 | ALDH1A1 (0.51) | ALDH1A1TP53SIGMAR1MAPTHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024163956-A2 | SIGMA RECEPTOR LIGAND COMPOUNDS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2024-08-08 | — | — | WO | disclosed |