Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.57 |
| ▸ | HTR6 | P50406 | 3/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1298103 | 0.76 | PARP1 (0.80) | PARP1PARP2 | |
| SCHEMBL2243349 | 0.74 | PARP1 (0.55) | PARP1HTR2B | |
| SCHEMBL5621707 | 0.72 | PARP1 (1.00) | PARP1PARP2 | |
| Hydrochloric Acid SCHEMBL18614370 | 0.71 | PARP1 (0.98) | PARP1PARP2 | |
| SCHEMBL11380250 | 0.70 | ALDH1A1 (0.45) | HTR6LTA4H | |
| SCHEMBL6872050 | 0.70 | PARP1 (0.70) | PARP1PARP2 | |
| SCHEMBL9307952 | 0.69 | NPC1 (0.46) | HTR6 | |
| SCHEMBL5071826 | 0.69 | PNP (0.52) | — | |
| SCHEMBL9306184 | 0.69 | GAA (0.42) | HTR6 | |
| SCHEMBL6697342 | 0.69 | DRD2 (0.50) | PARP1HTR6 |
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-0628549-B1 | New 1-phenylmethyl benzimidazole piperazine derivatives | ESPANOLA DE PRODUCTOS FAB (ES) | 2000-12-06 | — | — | EP | disclosed |