Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 10/20 | 0.58 |
| ▸ | HTR1A | P08908 | 2/20 | 0.53 |
| ▸ | HTR7 | P34969 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13071509 | 0.87 | DPP4 (0.57) | DPP4HTR1AHTR7 | |
| SCHEMBL13071386 | 0.85 | DPP4 (0.60) | DPP4HTR1AHTR7ALDH1A1DPP7 | |
| SCHEMBL13071515 | 0.85 | KMT2A (0.49) | DPP4THRBALOX12KMT2AHSD11B1 | |
| SCHEMBL13071511 | 0.82 | DPP4 (0.47) | DPP4HTR1AHTR7 | |
| SCHEMBL6792962 | 0.81 | THRB (0.55) | DPP4THRBALOX12KMT2AALDH1A1 | |
| SCHEMBL5544779 | 0.81 | THRB (0.55) | DPP4THRBALOX12KMT2AALDH1A1 | |
| SCHEMBL13071391 | 0.80 | DPP4 (0.50) | DPP4HTR1AHTR7 | |
| SCHEMBL12463762 | 0.80 | DPP4 (0.56) | DPP4HTR1AHTR7THRBALOX12 | |
| SCHEMBL13071376 | 0.78 | DPP4 (0.53) | DPP4ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL6786573 | 0.77 | THRB (0.51) | DPP4THRBALOX12KMT2A |
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 |