Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.36 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ATR | Q13535 | 2/20 | 0.34 |
| ▸ | ATRIP | Q8WXE1 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27700342 | 0.87 | DRD2 (0.33) | DRD2NR1H2SUCNR1SIGMAR1MAPK1 | |
| SCHEMBL3037100 | 0.87 | DRD2 (0.34) | DRD2NR1H2SUCNR1SIGMAR1MAPK1 | |
| SCHEMBL3037188 | 0.79 | PARP1 (0.36) | NR1H2 | |
| SCHEMBL5048352 | 0.76 | PARP1 (0.34) | NR1H2ATR | |
| SCHEMBL5140104 | 0.76 | NR1H2 (0.34) | NR1H2ATRATRIP | |
| SCHEMBL3052537 | 0.74 | PARP1 (0.35) | NR1H2 | |
| SCHEMBL3046855 | 0.74 | NR1H2 (0.39) | NR1H2BRD4ATRATRIP | |
| SCHEMBL3043944 | 0.74 | PARP1 (0.35) | NR1H2ATR | |
| SCHEMBL3144005 | 0.74 | NR1H2 (0.38) | NR1H2SUCNR1BRD4ATRATRIP | |
| SCHEMBL27700218 | 0.73 | NR1H2 (0.33) | NR1H2 |
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-1880993-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2008-01-23 | — | — | EP | disclosed |