Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8277483 | 0.77 | CHRM3 (0.37) | CHRM3CYP2C19CYP3A4TSHRHSD17B10 | |
| SCHEMBL1106414 | 0.72 | CHRM3 (0.34) | CHRM3CYP2C19CYP3A4TSHRHSD17B10 | |
| SCHEMBL22308307 | 0.72 | HPGD (0.35) | — | |
| SCHEMBL16869975 | 0.71 | DPP4 (0.39) | CHRM3CYP2C19CYP3A4TSHRHSD17B10 | |
| SCHEMBL17090680 | 0.68 | CYP2C19 (0.53) | CHRM3CYP2C19LMNA | |
| SCHEMBL30785553 | 0.68 | DPP4 (0.37) | CHRM3CYP2C19LMNA | |
| SCHEMBL12691717 | 0.68 | GRM5 (0.55) | CYP2C19 | |
| SCHEMBL20329006 | 0.67 | CHRM3 (0.33) | CHRM3 | |
| SCHEMBL322302 | 0.66 | KMT2A (0.46) | — | |
| SCHEMBL3585302 | 0.66 | S1PR5 (0.43) | — |
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-2020156323-A1 | IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF | BETTA PHARMACEUTICALS CO., LTD (CN) | 2020-08-06 | — | — | WO | disclosed |