Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.36 |
| ▸ | GRB2 | P62993 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | NTSR2 | O95665 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CASP4 | P49662 | 1/20 | 0.34 |
| ▸ | CASP5 | P51878 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.34 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | CTSV | O60911 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8250731 | 0.92 | ELANE (0.36) | ELANECASP1CASP4CASP5CASP7 | |
| SCHEMBL8246714 | 0.87 | ELANE (0.37) | ELANEOPRM1CASP1CASP4CASP5 | |
| SCHEMBL8250093 | 0.83 | NPSR1 (0.39) | GRB2F2OPRM1STAT3 | |
| SCHEMBL12601475 | 0.83 | ELANE (0.39) | ELANEGRB2F2CASP1CASP4 | |
| SCHEMBL8247468 | 0.82 | ELANE (0.43) | ELANEF2OPRM1CASP1CASP4 | |
| SCHEMBL12601266 | 0.81 | ELANE (0.46) | ELANEF2OPRM1CASP1CASP4 | |
| SCHEMBL8247918 | 0.81 | DPP4 (0.38) | GRB2F2OPRM1STAT3CTSK | |
| SCHEMBL8253477 | 0.81 | DPP4 (0.38) | GRB2F2OPRM1STAT3CTSK | |
| SCHEMBL8249903 | 0.81 | CASP1 (0.35) | ELANEOPRM1CASP1CASP4CASP5 | |
| SCHEMBL8250760 | 0.79 | NPSR1 (0.38) | F2OPRM1STAT3CTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005085242-A1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORPORATION (US) | 2005-09-15 | — | — | WO | disclosed |