Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | PPP3CB | P16298 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.36 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13409512 | 0.95 | CTSB (0.49) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL13444594 | 0.91 | CTSB (0.46) | CTSBPPP3CB | |
| SCHEMBL13409518 | 0.88 | CTSB (0.45) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL13444207 | 0.86 | CTSB (0.40) | CTSBPPP3CBCYP3A4 | |
| SCHEMBL13409533 | 0.83 | CTSB (0.70) | CTSBPPP3CBCYP3A4 | |
| SCHEMBL14116974 | 0.83 | CTSB (0.52) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL13409524 | 0.83 | CTSB (0.75) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL13409558 | 0.83 | CTSB (0.75) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL14092829 | 0.82 | CTSB (0.56) | CTSBPPP3CBCYP3A4ABCC1ABCC2 | |
| SCHEMBL14092828 | 0.82 | CTSB (0.55) | CTSBPPP3CBCYP3A4ABCC1ABCC2 |
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-7705146-B2 | Hepatitis C inhibitor peptide analogs | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-27 | — | — | US | disclosed |