Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.35 |
| ▸ | ITGAV | P06756 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR1F | P30939 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7040671 | 0.93 | PARP1 (0.50) | PARP1HTR2BPARP2HSD11B1CHRM1 | |
| SCHEMBL7045615 | 0.89 | PARP1 (0.51) | PARP1HTR2BPARP2 | |
| SCHEMBL7042003 | 0.87 | PARP1 (0.48) | PARP1HTR2BPARP2TLR7MEN1 | |
| SCHEMBL7038340 | 0.86 | PARP1 (0.48) | PARP1HTR2BHSD11B1MEN1KMT2A | |
| SCHEMBL7043510 | 0.85 | PARP1 (0.55) | PARP1HTR2BMEN1KMT2A | |
| SCHEMBL7043780 | 0.85 | PARP1 (0.47) | PARP1HTR2BPARP2HSD11B1 | |
| SCHEMBL7040495 | 0.85 | PARP1 (0.65) | PARP1PARP2 | |
| SCHEMBL7043077 | 0.83 | PARP1 (0.44) | PARP1HTR2BPARP2CHRM1 | |
| SCHEMBL7044945 | 0.83 | PARP1 (0.45) | PARP1HTR2BHSD11B1 | |
| SCHEMBL7041082 | 0.82 | PARP1 (0.52) | PARP1HTR2BMEN1KMT2A |
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-1133477-B1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2004-02-18 | — | — | EP | disclosed |