Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6070704 | 1.00 | TTR (0.46) | TTRAPPKDM4EALDH1A1PTPN1 | |
| SCHEMBL25234433 | 0.76 | PARP1 (0.61) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| SCHEMBL6069756 | 0.75 | PARP1 (0.39) | CCNB2CDK1CCNB1GSK3BCDK5 | |
| SCHEMBL5804213 | 0.75 | MAPT (0.51) | TTRAPPKDM4EALDH1A1JAK2 | |
| SCHEMBL5804215 | 0.75 | MAPT (0.51) | TTRAPPKDM4EALDH1A1JAK2 | |
| SCHEMBL6648775 | 0.72 | PARP1 (0.58) | KDM4EALDH1A1GAAMAPTHTT | |
| SCHEMBL7826963 | 0.72 | TTR (0.41) | TTRAPPKDM4EALDH1A1PTPN1 | |
| SCHEMBL7826959 | 0.72 | TTR (0.41) | TTRAPPKDM4EALDH1A1PTPN1 | |
| SCHEMBL6069689 | 0.71 | PARP1 (0.48) | PARP1 | |
| SCHEMBL11976881 | 0.71 | TTR (0.51) | TTRAPPKDM4EALDH1A1PTPN1 |
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-1129077-B9 | FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS | SCHERING AG (DE) | 2005-07-20 | — | — | EP | disclosed |
| EP-1129077-B1 | FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS | SCHERING AG (DE) | 2005-04-20 | — | — | EP | disclosed |