Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.68 |
| ▸ | EDNRA | P25101 | 10/20 | 0.59 |
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.48 |
| ▸ | CCR4 | P51679 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7357895 | 0.86 | ABCB11 (0.79) | ABCB11EDNRAPTGDR2CCR4 | |
| SCHEMBL7391495 | 0.86 | ABCB11 (0.71) | ABCB11EDNRAPTGDR2CCR4 | |
| SCHEMBL7361201 | 0.85 | ABCB11 (0.67) | ABCB11EDNRACCR4 | |
| SCHEMBL7360560 | 0.84 | ABCB11 (0.71) | ABCB11EDNRACCR4 | |
| SCHEMBL7398790 | 0.84 | ABCB11 (0.71) | ABCB11EDNRAPTGDR2CCR4 | |
| SCHEMBL7363388 | 0.84 | ABCB11 (0.73) | ABCB11EDNRAPTGDR2CCR4 | |
| SCHEMBL7364530 | 0.84 | ABCB11 (0.70) | ABCB11EDNRACCR4 | |
| SCHEMBL7364303 | 0.84 | ABCB11 (0.70) | ABCB11EDNRACCR4 | |
| SCHEMBL8026842 | 0.84 | ABCB11 (0.71) | ABCB11EDNRAPTGDR2CCR4 | |
| SCHEMBL7365882 | 0.84 | ABCB11 (0.76) | ABCB11EDNRACCR4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6060475-A | Substituted pyrazin-2-yl-sulphonamide-(3-pyridyl) compounds and uses thereof | ZENECA LIMITED (GB) | 2000-05-09 | — | — | US | disclosed |
| US-5866568-A | ENDOTHELIN RECEPTOR ANTAGONIST ACTIVITY | ZENECA LIMITED (GB) | 1999-02-02 | — | — | US | disclosed |
| EP-0832082-A1 | N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS | ZENECA LIMITED (GB) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996040681-A1 | N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS | ZENECA LIMITED (GB) | 1996-12-19 | — | — | WO | disclosed |