Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 9/20 | 0.64 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.46 |
| ▸ | EDNRB | P24530 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.37 |
| ▸ | ITGAL | P20701 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6159406 | 0.92 | EDNRA (0.63) | EDNRAAGTR1AGTR2KDM4EALDH1A1 | |
| SCHEMBL7498870 | 0.90 | EDNRA (0.59) | EDNRAAGTR1AGTR2EDNRBKDM4E | |
| SCHEMBL6160979 | 0.90 | EDNRA (0.63) | EDNRAAGTR1AGTR2EDNRBKDM4E | |
| SCHEMBL6162876 | 0.87 | EDNRA (0.60) | EDNRAAGTR1AGTR2EDNRBKDM4E | |
| SCHEMBL3837125 | 0.87 | EDNRA (0.70) | EDNRAAGTR1AGTR2KDM4EALDH1A1 | |
| SCHEMBL7501757 | 0.85 | EDNRA (0.55) | EDNRAEDNRB | |
| SCHEMBL8434768 | 0.82 | EDNRA (0.52) | EDNRAEDNRBKDM4EALDH1A1HPGD | |
| SCHEMBL7498348 | 0.81 | EDNRA (0.63) | EDNRAAGTR1AGTR2KDM4EALDH1A1 | |
| SCHEMBL8434967 | 0.81 | EDNRA (0.63) | EDNRAAGTR1AGTR2 | |
| SCHEMBL7496869 | 0.81 | EDNRA (0.66) | EDNRAAGTR1AGTR2KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5932741-A | TREATING ILLNESSES RESULTING FROM ABNORMAL STIMULATION OF ENDOTHELIN RECEPTORS | HOECHST MARION ROUSSEL (FR) | 1999-08-03 | — | — | US | disclosed |
| US-5811444-A | IMIDAZOLE DERIVATIVES | ROUSSEL UCLAF (FR) | 1998-09-22 | — | — | US | disclosed |