Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 4/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | PGR | P06401 | 1/20 | 0.56 |
| ▸ | RORA | P35398 | 1/20 | 0.51 |
| ▸ | RORC | P51449 | 1/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.50 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | SGK1 | O00141 | 1/20 | 0.48 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8392200 | 0.83 | EDNRA (0.67) | EDNRATSHRPGRRORARORC | |
| SCHEMBL8055281 | 0.81 | EDNRA (1.00) | EDNRA | |
| SCHEMBL8394279 | 0.81 | EDNRA (0.67) | EDNRATSHRPGRALDH1A1MEN1 | |
| SCHEMBL27415009 | 0.80 | P4HTM (0.67) | TSHRPGRRORARORCNR1H2 | |
| SCHEMBL8392321 | 0.80 | EDNRA (0.66) | EDNRATSHRPGRRORARORC | |
| SCHEMBL6409546 | 0.78 | TSHR (0.67) | TSHRPGRRORARORCNR1H2 | |
| SCHEMBL8390387 | 0.77 | EDNRA (0.66) | EDNRATSHRPGRRORARORC | |
| SCHEMBL9140469 | 0.77 | TSHR (0.55) | EDNRATSHRPGRRORARORC | |
| SCHEMBL812673 | 0.77 | TSHR (0.74) | EDNRATSHRPGRRORARORC | |
| SCHEMBL31110643 | 0.77 | TSHR (0.74) | EDNRATSHRPGRRORARORC |
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-0752986-B1 | N-HETEROCYCLYL SULPHONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS | ZENECA LTD (GB) | 1999-05-19 | — | — | EP | disclosed |