Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 17/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 13/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30327812 | 0.87 | HCRTR2 (0.43) | HCRTR2HCRTR1CYP17A1 | |
| SCHEMBL25163834 | 0.87 | HCRTR2 (0.43) | HCRTR2HCRTR1CYP17A1 | |
| SCHEMBL30329320 | 0.87 | HCRTR2 (0.38) | HCRTR2HCRTR1 | |
| SCHEMBL25164317 | 0.87 | HCRTR2 (0.38) | HCRTR2HCRTR1 | |
| SCHEMBL30327684 | 0.86 | HCRTR2 (0.40) | HCRTR2HCRTR1 | |
| SCHEMBL25164024 | 0.86 | HCRTR2 (0.40) | HCRTR2HCRTR1 | |
| SCHEMBL30328816 | 0.86 | HCRTR2 (0.46) | HCRTR2HCRTR1 | |
| SCHEMBL25164934 | 0.86 | ACACA (0.34) | HCRTR2HCRTR1CYP17A1RIPK1PTPN11 | |
| SCHEMBL25163494 | 0.86 | HCRTR2 (0.46) | HCRTR2HCRTR1 | |
| SCHEMBL25164376 | 0.86 | HCRTR2 (0.41) | HCRTR2HCRTR1 |
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 3 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 |
| WO-2023064343-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |