Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 8/20 | 0.50 |
| ▸ | HTR2B | P41595 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | RECQL | P46063 | 4/20 | 0.50 |
| ▸ | BLM | P54132 | 3/20 | 0.50 |
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | THPO | P40225 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7904596 | 1.00 | DRD1 (0.50) | DRD1HTR2BKDM4ERECQLBLM | |
| Bromide SCHEMBL10718013 | 0.99 | KDM4E (0.51) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL7325308 | 0.89 | DRD1 (0.60) | DRD1HTR2BKDM4ERECQLBLM | |
| Hydrochloric Acid SCHEMBL11269253 | 0.88 | DRD1 (0.59) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL11270427 | 0.88 | DRD1 (0.45) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL11607365 | 0.88 | DRD1 (0.47) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL11607907 | 0.88 | DRD1 (0.47) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL11607370 | 0.87 | DRD1 (0.47) | DRD1HTR2BKDM4ERECQLBLM | |
| Bromide SCHEMBL11257920 | 0.87 | DRD1 (0.48) | DRD1HTR2BKDM4ERECQLBLM | |
| SCHEMBL11238141 | 0.86 | DRD1 (0.43) | DRD1HTR2BKDM4ERECQLBLM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0087319-A1 | R- and S-isomers of 6-chloro-7,8-dihydroxy-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine | SMITHKLINE BECKMAN CORPORATION (US) | 1983-08-31 | — | — | EP | claimed |