Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 19/20 | 0.57 |
| ▸ | PIM1 | P11309 | 1/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.49 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.49 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5621641 | 0.96 | PARP1 (0.61) | PARP1AURKB | |
| SCHEMBL5621270 | 0.92 | PARP1 (0.60) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5620436 | 0.92 | PARP1 (0.56) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5621964 | 0.92 | PARP1 (0.56) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5622514 | 0.92 | PARP1 (0.56) | PARP1AURKB | |
| SCHEMBL5621861 | 0.92 | PARP1 (0.56) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5621674 | 0.90 | PARP1 (0.61) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5621653 | 0.89 | PARP1 (0.61) | PARP1 | |
| SCHEMBL5621736 | 0.89 | PARP1 (0.55) | PARP1PIM1FLT3PIM3BRSK1 | |
| SCHEMBL5621141 | 0.89 | PARP1 (0.53) | PARP1AURKB |
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 |