Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.58 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5620912 | 0.96 | PARP1 (0.53) | PARP1PARP2JAK2JAK1JAK3 | |
| SCHEMBL7705471 | 0.89 | PARP1 (0.62) | PARP1PARP2KCNH2 | |
| SCHEMBL7706345 | 0.88 | PARP1 (0.61) | PARP1PARP2DRD4HRH1 | |
| SCHEMBL7706351 | 0.88 | PARP1 (0.61) | PARP1PARP2DRD4 | |
| SCHEMBL7705624 | 0.86 | PARP1 (0.55) | PARP1PARP2KCNH2DRD4HRH1 | |
| SCHEMBL7708486 | 0.86 | PARP1 (0.58) | PARP1PARP2KCNH2HRH1 | |
| SCHEMBL5621235 | 0.86 | PARP1 (0.80) | PARP1PARP2 | |
| SCHEMBL7706349 | 0.86 | PARP1 (0.61) | PARP1PARP2KCNH2 | |
| SCHEMBL7705626 | 0.85 | PARP1 (0.56) | PARP1PARP2KCNH2 | |
| SCHEMBL7706365 | 0.85 | PARP1 (0.57) | PARP1PARP2KCNH2 |
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 |