Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.78 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.61 |
| ▸ | MMP12 | P39900 | 1/20 | 0.60 |
| ▸ | DRD4 | P21917 | 7/20 | 0.53 |
| ▸ | DRD2 | P14416 | 6/20 | 0.53 |
| ▸ | DRD3 | P35462 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HTR1D | P28221 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL12844300 | 1.00 | PARP1 (0.78) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL21207261 | 0.91 | PARP1 (0.74) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL11002313 | 0.91 | PARP1 (0.77) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL8195715 | 0.88 | PARP1 (0.60) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL532134 | 0.88 | PARP1 (1.00) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL9437714 | 0.86 | PARP1 (0.67) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL11006154 | 0.86 | PARP1 (0.70) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL11004751 | 0.86 | PARP1 (0.70) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL21177010 | 0.86 | PARP1 (0.79) | PARP1NR3C2MMP12DRD4DRD2 | |
| SCHEMBL4271023 | 0.85 | MMP12 (0.70) | PARP1NR3C2MMP12DRD4DRD2 |
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 |