Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.39 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.39 |
| ▸ | TRAP1 | Q12931 | 5/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.36 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6580193 | 0.84 | ADORA2A (0.41) | ADORA2AHSP90AA1HSP90B1TRAP1CRHBP | |
| SCHEMBL3392282 | 0.74 | ADORA2A (0.68) | ADORA2AHSP90AA1HSP90B1TRAP1 | |
| SCHEMBL3834423 | 0.73 | HSP90AA1 (0.43) | ADORA2AHSP90AA1HSP90B1TRAP1CRHBP | |
| SCHEMBL7501419 | 0.72 | KCNH2 (0.44) | ADORA2ASLC22A12P2RX7MEN1KMT2A | |
| SCHEMBL7503934 | 0.71 | HSP90AA1 (0.41) | ADORA2AHSP90AA1HSP90B1TRAP1CRHBP | |
| SCHEMBL8664779 | 0.70 | BRS3 (0.51) | ADORA2ASLC22A12PDE5AALDH1A1HPGD | |
| SCHEMBL3834411 | 0.70 | HSP90AA1 (0.42) | ADORA2AHSP90AA1HSP90B1TRAP1CRHBP | |
| SCHEMBL6161550 | 0.70 | CYP2D6 (0.53) | ADORA2ASLC22A12P2RX7SMN1; SMN2 | |
| SCHEMBL11013613 | 0.69 | CYP19A1 (0.50) | MAPT | |
| SCHEMBL6159202 | 0.69 | KCNH2 (0.48) | ADORA2AHSP90AA1HSP90B1SLC22A12P2RX7 |
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-0804435-B1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | AVENTIS PHARMA SA (FR) | 2004-03-10 | — | — | EP | disclosed |
| US-5856509-A | HYPOTENSIVE AGENTS | ROUSSEL UCLAF (FR) | 1999-01-05 | — | — | US | disclosed |
| EP-0804435-A1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | ROUSSEL UCLAF (FR) | 1997-11-05 | — | — | EP | disclosed |
| WO-1996004275-A1 | NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | ROUSSEL UCLAF (FR) | 1996-02-15 | — | — | WO | disclosed |