Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14408233 | 1.00 | ADRB3 (0.49) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL13051894 | 1.00 | ADRB3 (0.49) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL13886255 | 0.93 | ADRB3 (0.53) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL13509141 | 0.93 | ADRB3 (0.47) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL14001907 | 0.92 | ADRB3 (0.49) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL14561440 | 0.90 | ADRB3 (0.51) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL13892482 | 0.89 | ADRB3 (0.50) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL8293914 | 0.87 | ADRB3 (0.45) | ADRB3ADRA2BADRA2CCYP3A4TSHR | |
| SCHEMBL15318736 | 0.87 | ADRB3 (0.46) | ADRB3ADRA2BADRA2CCYP3A4 | |
| SCHEMBL8145663 | 0.87 | ADRB3 (0.46) | ADRB3ADRA2BADRA2CCYP3A4 |
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-7642235-B2 | Macrocyclic peptides active against the hepatitis C virus | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-01-05 | — | — | US | disclosed |