Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.48 |
| ▸ | BIRC2 | Q13490 | 5/20 | 0.40 |
| ▸ | XIAP | P98170 | 2/20 | 0.40 |
| ▸ | BIRC3 | Q13489 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | CASP4 | P49662 | 1/20 | 0.40 |
| ▸ | CASP5 | P51878 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | CASP9 | P55211 | 1/20 | 0.40 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.40 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 3/20 | 0.39 |
| ▸ | REN | P00797 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5992865 | 0.89 | ELANE (0.45) | ELANEBIRC2XIAPBIRC3CASP1 | |
| SCHEMBL20611079 | 0.87 | ACE (0.51) | ELANEF2CYP2C19ACEREN | |
| SCHEMBL12403760 | 0.87 | ELANE (0.46) | ELANEBIRC2XIAPBIRC3CYP3A4 | |
| SCHEMBL5995965 | 0.87 | ELANE (0.46) | ELANEBIRC2XIAPBIRC3CYP3A4 | |
| SCHEMBL14050770 | 0.85 | BIRC2 (0.54) | ELANEBIRC2XIAPBIRC3CASP9 | |
| SCHEMBL15304272 | 0.85 | BIRC2 (0.54) | ELANEBIRC2XIAPBIRC3CASP9 | |
| SCHEMBL806061 | 0.85 | ELANE (0.45) | ELANEBIRC2XIAPBIRC3ACE | |
| SCHEMBL12676948 | 0.83 | ELANE (0.43) | ELANEBIRC2XIAPBIRC3 | |
| SCHEMBL5992754 | 0.83 | ELANE (0.43) | ELANEBIRC2XIAPBIRC3CYP3A4 | |
| SCHEMBL15196612 | 0.82 | ELANE (0.42) | ELANEBIRC2XIAPBIRC3CASP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012083164-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012083170-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |
| EP-2368890-A1 | Hepatitis C virus inhibitors | Abbott Laboratories (US) | 2011-09-28 | — | — | EP | disclosed |
| WO-2010144646-A2 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2010-12-16 | — | — | WO | disclosed |
| WO-2010120935-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2010-10-21 | — | — | WO | disclosed |