Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 7/20 | 0.47 |
| ▸ | EDNRA | P25101 | 3/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL8551374 | 0.94 | EDNRB (0.47) | EDNRBEDNRAMAPTPOLBCRHR1 | |
| SCHEMBL8551757 | 0.93 | EDNRB (0.44) | EDNRBEDNRAAGTR2MAPTPOLB | |
| SCHEMBL8550816 | 0.92 | EDNRB (0.43) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8591727 | 0.91 | EDNRB (0.56) | EDNRBEDNRAAGTR2MAPTPOLB | |
| SCHEMBL8549513 | 0.90 | EDNRB (0.57) | EDNRBEDNRAAGTR2AGTR1MAPT | |
| SCHEMBL8551305 | 0.89 | EDNRB (0.47) | EDNRBEDNRAAGTR2AGTR1POLB | |
| SCHEMBL8551085 | 0.88 | EDNRB (0.45) | EDNRBEDNRAMAPTPOLBCRHR1 | |
| SCHEMBL8552637 | 0.86 | EDNRB (0.44) | EDNRBEDNRAMAPTPOLBCRHR1 | |
| SCHEMBL8624245 | 0.85 | EDNRB (0.43) | EDNRBEDNRAAGTR2AGTR1POLB | |
| SCHEMBL8552260 | 0.85 | EDNRB (0.47) | EDNRBEDNRAAGTR2AGTR1 |
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-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |