Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 2/20 | 0.49 |
| ▸ | IDH2 | P48735 | 1/20 | 0.49 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | NAMPT | P43490 | 6/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30328847 | 0.94 | IDH1 (0.50) | IDH1IDH2GPR119HCRTR2CNR2 | |
| SCHEMBL27157988 | 0.87 | IDH1 (0.48) | IDH1IDH2GPR119HCRTR2CNR2 | |
| SCHEMBL27158820 | 0.83 | IDH1 (0.52) | IDH1IDH2GPR119TGFBR1 | |
| SCHEMBL30328455 | 0.82 | GPR119 (0.50) | IDH1IDH2GPR119HCRTR2CNR2 | |
| SCHEMBL30328983 | 0.82 | IDH1 (0.50) | IDH1IDH2GPR119HCRTR2NAMPT | |
| SCHEMBL27157813 | 0.79 | LOXL2 (0.51) | IDH1IDH2GPR119 | |
| SCHEMBL29912773 | 0.77 | IDH1 (0.44) | IDH1IDH2GPR119HCRTR2NAMPT | |
| SCHEMBL13705108 | 0.77 | IDH1 (0.46) | IDH1IDH2GPR119HCRTR2 | |
| Hydrochloric Acid SCHEMBL30329324 | 0.76 | HCRTR2 (0.34) | IDH1IDH2HCRTR2TACR1 | |
| SCHEMBL29608608 | 0.76 | GPR119 (0.49) | GPR119NAMPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4415706-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | Vanqua Bio, Inc. (US) | 2024-08-21 | — | — | EP | disclosed |
| WO-2023064343-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |