Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 10/20 | 0.49 |
| ▸ | EDNRB | P24530 | 9/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 8/20 | 0.33 |
| ▸ | PPARA | Q07869 | 7/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.32 |
| ▸ | FLT4 | P35916 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL8903653 | 0.93 | EDNRA (0.46) | EDNRAEDNRBAGTR1AGTR2FLT1 | |
| SCHEMBL8906313 | 0.86 | EDNRA (0.64) | EDNRAEDNRBAGTR1AGTR2 | |
| SCHEMBL7341465 | 0.85 | EDNRA (0.44) | EDNRAEDNRBAGTR1AGTR2PPARG | |
| SCHEMBL8903655 | 0.79 | EDNRA (0.61) | EDNRAEDNRBAGTR1 | |
| SCHEMBL7339637 | 0.78 | EDNRA (0.42) | EDNRAEDNRBAGTR1AGTR2PPARG | |
| SCHEMBL7332065 | 0.77 | EDNRA (0.63) | EDNRAEDNRBAGTR1 | |
| SCHEMBL8904132 | 0.76 | EDNRA (0.78) | EDNRAEDNRBAGTR1AGTR2 | |
| SCHEMBL8788478 | 0.72 | EDNRA (0.59) | EDNRAEDNRBAGTR1 | |
| SCHEMBL8681751 | 0.72 | EDNRA (0.43) | EDNRAEDNRBAGTR1AGTR2PPARG | |
| SCHEMBL7341468 | 0.72 | EDNRA (0.58) | EDNRAEDNRBAGTR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5668176-A | ENDOTHELIN ANTAGONIST | MERCK & CO. INC. (US) | 1997-09-16 | — | — | US | disclosed |
| US-5565485-A | TREATING CARDIOVASCULAR DISORDERS | MERCK & CO., INC. (US) | 1996-10-15 | — | — | US | disclosed |
| WO-1996009818-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS FOR THE TREATMENT OF EMESIS | MERCK & CO., INC. (US) | 1996-04-04 | — | — | WO | disclosed |