Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 6/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.40 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5619804 | 0.85 | PARP1 (0.67) | PARP1HTR2BHSD11B1 | |
| SCHEMBL7038340 | 0.82 | PARP1 (0.48) | PARP1PDE10AHTR2BBRD4HSD11B1 | |
| SCHEMBL5622558 | 0.80 | PARP1 (0.62) | PARP1PROKR1 | |
| SCHEMBL11923730 | 0.79 | PDE10A (0.53) | PARP1PDE10AHTR2BBRD4 | |
| SCHEMBL6756278 | 0.78 | TLR7 (0.54) | PARP1PDE10A | |
| SCHEMBL7044945 | 0.77 | PARP1 (0.45) | PARP1HTR2BHSD11B1PROKR1BTK | |
| SCHEMBL7465623 | 0.75 | NPY1R (0.48) | PARP1PDE10A | |
| SCHEMBL21348799 | 0.73 | PDE10A (0.48) | PARP1PDE10APARP14 | |
| SCHEMBL2636396 | 0.72 | HTR2B (0.66) | PDE10AHTR2BHSD11B1PROKR1RAB9A | |
| SCHEMBL5621671 | 0.71 | PARP1 (0.71) | PARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1133477-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000032579-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-08 | — | — | WO | disclosed |