Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.39 |
| ▸ | FTO | Q9C0B1 | 6/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL917830 | 0.89 | PARP1 (0.37) | PARP1FTOPOLBALDH1A1ALKBH5 | |
| SCHEMBL14837119 | 0.86 | PARP1 (0.38) | PARP1FTOALDH1A1LMNA | |
| SCHEMBL918647 | 0.85 | FTO (0.36) | PARP1FTOPOLBALKBH5 | |
| SCHEMBL14837487 | 0.82 | ACHE (0.40) | PARP1FTOPOLBALDH1A1ALKBH5 | |
| SCHEMBL14837200 | 0.78 | PARP1 (0.43) | PARP1ALDH1A1LMNAKDM4EGLA | |
| SCHEMBL917909 | 0.78 | PARP1 (0.39) | PARP1 | |
| SCHEMBL14836947 | 0.77 | PARP1 (0.39) | PARP1 | |
| SCHEMBL917641 | 0.77 | PARP1 (0.38) | PARP1ALDH1A1 | |
| SCHEMBL14837279 | 0.76 | L3MBTL1 (0.50) | PARP1POLBALDH1A1 | |
| SCHEMBL918232 | 0.75 | PARP1 (0.35) | PARP1FTOALDH1A1GAAHSD17B10 |
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-1758864-B1 | Substituted tetrahydro-2H-isoquinolin-1-one derivatives, method for their preparation, and their use as medicaments | SANOFI AVENTIS DEUTSCHLAND (DE) | 2013-04-10 | — | — | EP | disclosed |
| CN-1968929-B | Substituted tetrahydro-2h-isoquinolin-1-one derivatives, method for the production thereof, and use of the same as medicaments | SANOFI AVENTIS DEUTSCHLAND | 2010-09-08 | — | — | CN | disclosed |