Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.35 |
| ▸ | HRH1 | P35367 | 3/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21281500 | 0.86 | ADRA1A (0.45) | PARP1HTR7ADRA1AADRA1BHTR1A | |
| SCHEMBL21274526 | 0.85 | DRD4 (0.40) | P2RX7PARP1HTR7SIRT6HTR1A | |
| SCHEMBL21273939 | 0.83 | SLC6A2 (0.47) | HTR7ADRA1AHRH1ADRA1BKCNH2 | |
| SCHEMBL21274069 | 0.81 | PARP1 (0.52) | PARP1HTR7HRH3ALDH1A1 | |
| SCHEMBL21274094 | 0.81 | PARP1 (0.50) | PARP1HTR7 | |
| SCHEMBL21274120 | 0.81 | PARP1 (0.36) | SIGMAR1PARP1HTR7HTR1ADRD2 | |
| SCHEMBL21274021 | 0.81 | SIGMAR1 (0.37) | SIGMAR1PARP1HTR7HTR1ADRD2 | |
| SCHEMBL21274101 | 0.81 | NPC1 (0.55) | HTR7ADRA1AADRA1BHTR1ADRD2 | |
| SCHEMBL21273966 | 0.80 | DRD2 (0.45) | PARP1HTR7HTR1ADRD2HTR2A | |
| SCHEMBL21281583 | 0.80 | PARP1 (0.51) | PARP1HTR7HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3527209-A1 | PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES | UCB Biopharma SPRL (BE) | 2019-08-21 | — | — | EP | disclosed |