Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 3/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL30328809 | 1.00 | HCRTR2 (0.40) | HCRTR2HCRTR1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL25163634 | 0.92 | HCRTR2 (0.40) | HCRTR2HCRTR1CXCR3 | |
| SCHEMBL30329493 | 0.92 | HCRTR2 (0.40) | HCRTR2HCRTR1CXCR3 | |
| SCHEMBL30328835 | 0.91 | HCRTR2 (0.39) | HCRTR2HCRTR1KMT2AMEN1 | |
| SCHEMBL25164755 | 0.91 | HCRTR2 (0.39) | HCRTR2HCRTR1KMT2AMEN1 | |
| SCHEMBL25164696 | 0.85 | HCRTR2 (0.40) | HCRTR2HCRTR1 | |
| SCHEMBL30328252 | 0.85 | HCRTR2 (0.40) | HCRTR2HCRTR1 | |
| SCHEMBL30328942 | 0.85 | HCRTR2 (0.44) | HCRTR2HCRTR1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL25164719 | 0.85 | HCRTR2 (0.44) | HCRTR2HCRTR1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL25164325 | 0.84 | HCRTR2 (0.36) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023064343-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |