Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GPX4 | P36969 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL30216634 | 1.00 | KMT2A (0.38) | KMT2AMEN1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL30216630 | 0.86 | MEN1 (0.35) | KMT2AMEN1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL1002847 | 0.76 | MCHR1 (0.36) | KMT2AADRA1AADRA1BCHRM2CHRM4 | |
| SCHEMBL1004285 | 0.70 | LMNA (0.40) | CYP3A4ADRA1A | |
| SCHEMBL7441149 | 0.69 | HSD17B2 (0.39) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL3551369 | 0.69 | LMNA (0.41) | CYP3A4CYP2C19MDM2SMN1; SMN2MGLL | |
| SCHEMBL5718440 | 0.67 | CHRM2 (0.46) | KMT2AMEN1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL3556189 | 0.67 | MCHR1 (0.44) | KMT2AADRA1AGAACHRM2CHRM4 | |
| SCHEMBL13074142 | 0.64 | PER2 (0.39) | KMT2AMEN1MAPTADRA1AADRA1B | |
| SCHEMBL29915095 | 0.64 | DRD2 (0.53) | KMT2AMEN1CYP1A2CYP2C19CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115697327-A | 5-oxo-pyrrolidine-3-carboxamides as NAV1.8 inhibitors | 默沙东有限责任公司 | 2023-02-03 | — | — | CN | disclosed |