Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 10/20 | 0.64 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.51 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | TYK2 | P29597 | 1/20 | 0.46 |
| ▸ | JAK3 | P52333 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | PRCP | P42785 | 1/20 | 0.42 |
| ▸ | EBP | Q15125 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5622195 | 0.95 | PARP1 (0.71) | PARP1PARP2JAK2JAK1TYK2 | |
| SCHEMBL7700467 | 0.92 | PARP1 (0.67) | PARP1PARP2DRD3SIGMAR1DRD4 | |
| SCHEMBL5621929 | 0.92 | PARP1 (0.64) | PARP1PARP2DRD3SIGMAR1DRD4 | |
| SCHEMBL5621116 | 0.92 | PARP1 (0.67) | PARP1PARP2DRD3SIGMAR1DRD4 | |
| SCHEMBL5621780 | 0.91 | PARP1 (0.66) | PARP1PARP2DRD3SIGMAR1DRD4 | |
| SCHEMBL5622232 | 0.90 | PARP1 (0.79) | PARP1PARP2JAK2JAK1TYK2 | |
| SCHEMBL5621198 | 0.90 | PARP1 (0.61) | PARP1PARP2DRD3DRD2 | |
| SCHEMBL5621794 | 0.90 | PARP1 (0.61) | PARP1PARP2DRD3SIGMAR1DRD2 | |
| SCHEMBL7708434 | 0.89 | PARP1 (0.71) | PARP1PARP2DRD3 | |
| SCHEMBL5620203 | 0.89 | PARP1 (0.70) | PARP1PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE39608-E1 | Substituted benzimidazoles and their use as PARP inhibitors | ABBOTT GMBH & CO. KG (DE) | 2007-05-01 | — | — | US | disclosed |
| US-6448271-B1 | SUCH AS 2-(PIPERIDIN-4-YL)BENZIMIDAZOLE-4-CARBOXAMIDE; INHIBITORS OF ENZYME POLY(ADP-RIBOSE)POLYMERASE; IMPROVED WATER SOLUBILITY | BASF AKTIENGESELLSCHAFT (DE) | 2002-09-10 | — | — | US | disclosed |