Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL7873466 | 0.93 | ADRB3 (0.40) | ADRB3ADRA2BADRA2CKDM4EL3MBTL1 | |
| SCHEMBL13071506 | 0.91 | ADRB3 (0.40) | ADRB3ADRA2BADRA2CHDAC1HDAC8 | |
| SCHEMBL13071860 | 0.91 | ADRB3 (0.39) | ADRB3ADRA2BADRA2CHDAC1HDAC8 | |
| SCHEMBL13071382 | 0.86 | CYP3A4 (0.39) | ADRB3ADRA2BADRA2C | |
| SCHEMBL7873503 | 0.86 | ADRB3 (0.39) | ADRB3ADRA2BADRA2CL3MBTL1BTK | |
| SCHEMBL7866442 | 0.83 | ADRB3 (0.37) | ADRB3ADRA2BADRA2CBTK | |
| SCHEMBL16512401 | 0.82 | ADRB3 (0.38) | ADRB3ADRA2BADRA2C | |
| SCHEMBL12730850 | 0.82 | ADRB3 (0.39) | ADRB3ADRA2BADRA2C | |
| SCHEMBL12777041 | 0.82 | ADRB3 (0.39) | ADRB3ADRA2BADRA2C | |
| SCHEMBL12618532 | 0.82 | ADRB3 (0.52) | ADRB3ADRA2BADRA2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009142842-A9 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2010-11-25 | — | — | WO | disclosed |
| WO-2009142842-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2009-11-26 | — | — | WO | disclosed |