Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8800315 | 0.99 | PARP1 (0.43) | PARP1HTR2ASLC6A2PIM1PIM2 | |
| SCHEMBL8798434 | 0.88 | PARP1 (0.48) | PARP1HTR2AKDM4EMEN1MAPT | |
| Hydrochloric Acid SCHEMBL8800976 | 0.87 | PARP1 (0.47) | PARP1HTR2AKDM4EMEN1MAPT | |
| Hydrochloric Acid SCHEMBL8801079 | 0.87 | PARP1 (0.47) | PARP1HTR2AKDM4EMEN1MAPT | |
| Hydrochloric Acid SCHEMBL9484143 | 0.87 | PARP1 (0.47) | PARP1HTR2AKDM4EMEN1MAPT | |
| SCHEMBL8799223 | 0.85 | PARP1 (0.41) | PARP1PIM1PIM2CYP3A4 | |
| SCHEMBL8800588 | 0.85 | PARP1 (0.45) | PARP1HTR2ASLC6A2PIM1PIM2 | |
| SCHEMBL8801679 | 0.80 | PARP1 (0.50) | PARP1HTR2AALDH1A1MAPTHTR2C | |
| SCHEMBL8799810 | 0.80 | PARP1 (0.50) | PARP1HTR2AALDH1A1MAPTHTR2C | |
| SCHEMBL8800208 | 0.80 | PARP1 (0.50) | PARP1HTR2AALDH1A1MAPTHTR2C |
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-0525584-B1 | 6-Oxo-azepinoindole derivatives, process and intermediates for their preparation and medicaments containing them | SOLVAY PHARM GMBH (DE) | 1997-12-10 | — | — | EP | disclosed |
| US-5272143-A | 6-oxoazepinoindole compounds, and pharmaceutical compositions containing them | KALI-CHEMIE PHARMA GMBH (DE) | 1993-12-21 | — | — | US | disclosed |