Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7573709 | 0.89 | EDNRB (0.46) | EDNRBTSHRMAPK1ALDH1A1ACLY | |
| SCHEMBL7568104 | 0.86 | EDNRB (0.57) | EDNRBTP53TSHRMAPK1POLB | |
| SCHEMBL7570795 | 0.84 | EDNRB (0.59) | EDNRBSLC6A2SLC6A4SLC6A3HRH3 | |
| SCHEMBL8771691 | 0.83 | EDNRB (0.49) | EDNRBSLC6A2SLC6A4SLC6A3HRH3 | |
| SCHEMBL7575128 | 0.80 | EDNRA (0.47) | EDNRBTSHREDNRAALDH1A1TDP1 | |
| SCHEMBL8771517 | 0.80 | ALDH1A1 (0.42) | EDNRBEDNRAALDH1A1 | |
| SCHEMBL7570806 | 0.79 | TP53 (0.39) | SLC6A2SLC6A4SLC6A3HRH3TP53 | |
| SCHEMBL7573656 | 0.78 | EDNRB (0.56) | EDNRBTSHRMAPK1POLBALDH1A1 | |
| SCHEMBL7565610 | 0.76 | EDNRB (0.57) | EDNRBTSHRALDH1A1 | |
| SCHEMBL7565817 | 0.75 | EDNRB (0.53) | EDNRBTSHRMAPK1EDNRAALDH1A1 |
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-0799206-B1 | ARYL- AND HETARYL-SULFONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2002-09-11 | — | — | EP | claimed |