Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | RAMP1 | O60894 | 3/20 | 0.31 |
| ▸ | CALCRL | Q16602 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3470908 | 0.91 | GAA (0.34) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL3470904 | 0.91 | GAA (0.34) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL13082483 | 0.89 | ADRB3 (0.39) | ADRB3ADRA2BADRA2CGAACYP3A4 | |
| SCHEMBL3063426 | 0.89 | CYP3A4 (0.35) | ADRB3ADRA2BADRA2CGAACYP3A4 | |
| SCHEMBL8110198 | 0.89 | CYP3A4 (0.35) | ADRB3ADRA2BADRA2CGAACYP3A4 | |
| SCHEMBL5534012 | 0.88 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL5530647 | 0.88 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL7876742 | 0.88 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL2624064 | 0.88 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CGAAF2 | |
| SCHEMBL5534015 | 0.88 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CGAAF2 |
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-2007015824-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2007-02-08 | — | — | WO | disclosed |