Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.38 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.38 |
| ▸ | TRAP1 | Q12931 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | BRS3 | P32247 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6164112 | 0.86 | EDNRA (0.49) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL3837034 | 0.84 | HSP90AA1 (0.38) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL7503934 | 0.82 | HSP90AA1 (0.41) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL3834423 | 0.81 | HSP90AA1 (0.43) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL7501751 | 0.80 | ALDH1A1 (0.45) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL6159828 | 0.79 | HSP90AA1 (0.39) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL3834411 | 0.77 | HSP90AA1 (0.42) | EDNRAHSP90AA1HSP90B1TRAP1ALDH1A1 | |
| SCHEMBL7498348 | 0.77 | EDNRA (0.63) | EDNRAALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL3839122 | 0.76 | EDNRA (0.65) | EDNRAALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL8431142 | 0.75 | EDNRA (0.61) | EDNRAALDH1A1KDM4EHPGDSMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863896-B1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, PHARMACEUTICAL COMPOSITIONS AND USE OF SAID DERIVATIVES AS ENDOTHELIN ANTAGONISTS | AVENTIS PHARMA SA (FR) | 2005-02-09 | — | — | EP | disclosed |
| US-5986103-A | IMIDAZOLE SUBSTITUTED BENZENE AND REDUCTION OF ABNORMAL STIMULATION OF ENDOTHELIN RECEPTORS | HOECHST MARION ROUSSEL (FR) | 1999-11-16 | — | — | US | disclosed |
| EP-0863896-A1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, RESULTING INTERMEDIATES, PHARMACEUTICAL COMPOSITIONS AND USE OF SAID DERIVATIVES AS ENDOTHELIN ANTAGONISTS | HOECHST MARION ROUSSEL (FR) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997017340-A1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, RESULTING INTERMEDIATES, PHARMACEUTICAL COMPOSITIONS AND USE OF SAID DERIVATIVES AS ENDOTHELIN ANTAGONISTS | HOECHST MARION ROUSSEL (FR) | 1997-05-15 | — | — | WO | disclosed |