Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY1R | P25929 | 3/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 7/20 | 0.46 |
| ▸ | DRD4 | P21917 | 5/20 | 0.46 |
| ▸ | DRD3 | P35462 | 5/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7465623 | 0.94 | NPY1R (0.48) | NPY1RPARP1POLBTDP1DRD2 | |
| SCHEMBL5622218 | 0.82 | PARP1 (0.76) | PARP1DRD2DRD4 | |
| SCHEMBL11923730 | 0.82 | PDE10A (0.53) | PARP1PDE10AHTR3A | |
| SCHEMBL7043510 | 0.80 | PARP1 (0.55) | PARP1POLBTDP1DRD2DRD4 | |
| SCHEMBL13777216 | 0.79 | GRM2 (0.70) | NPY1RDRD2DRD4DRD3GRM2 | |
| SCHEMBL6756278 | 0.78 | TLR7 (0.54) | PARP1POLBMEN1KMT2APDE10A | |
| SCHEMBL5620889 | 0.77 | PARP1 (0.71) | PARP1DRD2 | |
| SCHEMBL21348799 | 0.76 | PDE10A (0.48) | PARP1PDE10AHTR3A | |
| SCHEMBL7041082 | 0.75 | PARP1 (0.52) | PARP1DRD2DRD4MEN1KMT2A | |
| SCHEMBL13450177 | 0.72 | MEN1 (0.67) | POLBDRD2DRD4DRD3ACHE |
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 |