Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229383 | 0.95 | HTT (0.30) | HTTNCOA1SMN1; SMN2NCOA3CYP1A2 | |
| SCHEMBL14228963 | 0.88 | HTT (0.31) | HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL14200697 | 0.86 | — | — | |
| SCHEMBL14200774 | 0.84 | — | — | |
| SCHEMBL14229391 | 0.82 | FDPS (0.31) | HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL14229050 | 0.78 | HTT (0.44) | HTTNCOA1SMN1; SMN2NCOA3CYP1A2 | |
| SCHEMBL14228956 | 0.76 | HTT (0.42) | HTTNCOA1SMN1; SMN2NCOA3CYP1A2 | |
| SCHEMBL14200676 | 0.74 | — | — | |
| SCHEMBL14229052 | 0.72 | HTT (0.44) | HTTNCOA1SMN1; SMN2NCOA3CYP1A2 | |
| SCHEMBL14200698 | 0.72 | — | — |
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-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |