Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER1 | P34995 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8962259 | 0.86 | EPHX1 (0.33) | POLBEPHX1 | |
| SCHEMBL24019746 | 0.81 | EPHX1 (0.33) | POLBEPHX1 | |
| SCHEMBL13686206 | 0.79 | TDP1 (0.33) | — | |
| SCHEMBL14586324 | 0.77 | EPHX1 (0.31) | POLBEPHX1 | |
| SCHEMBL132657 | 0.75 | DGAT1 (0.42) | — | |
| SCHEMBL14618042 | 0.74 | EPHX1 (0.36) | POLBEPHX1 | |
| SCHEMBL13684338 | 0.74 | CA1 (0.38) | — | |
| Ammonia Solution, Strong SCHEMBL9998482 | 0.73 | DGAT1 (0.41) | — | |
| SCHEMBL19139139 | 0.73 | EPHX1 (0.34) | POLBAPEX1EPHX1 | |
| SCHEMBL7365542 | 0.72 | TDP1 (0.34) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7173004-B2 | Macrocyclic isoquinoline peptide inhibitors of hepatitis C virus | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-02-06 | — | — | US | disclosed |