Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.30 |
| ▸ | PHGDH | O43175 | 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 | |
|---|---|---|---|---|
| SCHEMBL25164195 | 1.00 | MEN1 (0.33) | MEN1KMT2AGRIN2BSLC6A9SLC6A5 | |
| SCHEMBL25163843 | 0.89 | GRIN2B (0.33) | GRIN2B | |
| SCHEMBL30328258 | 0.87 | CXCR3 (0.34) | GRIN2BSLC6A9GRIN1CYP1A2CYP3A4 | |
| SCHEMBL25163965 | 0.87 | CXCR3 (0.34) | GRIN2BSLC6A9GRIN1CYP1A2CYP3A4 | |
| SCHEMBL25164129 | 0.86 | CYP2D6 (0.34) | GRIN2BGRIN1CYP1A2CYP3A4TSHR | |
| SCHEMBL30329117 | 0.86 | CYP2D6 (0.34) | GRIN2BGRIN1CYP1A2CYP3A4TSHR | |
| SCHEMBL25163674 | 0.86 | CNR2 (0.31) | GRIN2B | |
| SCHEMBL30328728 | 0.86 | CNR2 (0.31) | GRIN2B | |
| SCHEMBL25164744 | 0.85 | SMN1; SMN2 (0.38) | MEN1KMT2ACYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL25164468 | 0.85 | SMN1; SMN2 (0.38) | MEN1KMT2ACYP1A2CYP3A4SMN1; SMN2 |
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 |