Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.56 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | PKN1 | Q16512 | 2/20 | 0.50 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.50 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.48 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.47 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.47 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.47 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6585078 | 0.86 | PARP1 (0.44) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL6806909 | 0.84 | KDM4E (0.38) | PARP1PLA2G2AALOX15PTGS2DYRK1A | |
| SCHEMBL6806325 | 0.74 | PARP1 (0.62) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| Hydrochloric Acid SCHEMBL6809753 | 0.73 | PARP1 (0.60) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL7319077 | 0.71 | PARP1 (1.00) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL29411925 | 0.70 | PARP1 (0.72) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL6842030 | 0.70 | PARP1 (0.67) | PARP1PKN1PKN2DHODHCHEK2 | |
| SCHEMBL458836 | 0.70 | PARP1 (1.00) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL29412034 | 0.70 | PARP1 (1.00) | PARP1PLA2G2AALOX15PTGS2PKN1 | |
| SCHEMBL4321727 | 0.69 | PARP1 (1.00) | PARP1PLA2G2AALOX15PTGS2PKN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |