Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | SORD | Q00796 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17712625 | 0.83 | CHRM4 (0.47) | CYP11B2GPR119CHRM4MAPT | |
| SCHEMBL121185 | 0.83 | CYP11B2 (0.46) | CYP11B2GPR119CHRM4 | |
| SCHEMBL460460 | 0.82 | KDM4E (0.56) | KDM4ECYP2C19ADRA1DADRA1AADRA1B | |
| SCHEMBL1922288 | 0.80 | GPR119 (0.51) | CYP11B2GPR119 | |
| SCHEMBL4418417 | 0.79 | KDM4E (0.49) | KDM4ECYP2C19DRD2DRD3ADRA1D | |
| SCHEMBL17712642 | 0.79 | CHRM3 (0.45) | CYP11B2CHRM4 | |
| SCHEMBL28849506 | 0.78 | CYP11B2 (0.43) | CYP11B2GPR119CHRM4MAPT | |
| SCHEMBL388434 | 0.76 | DRD2 (0.47) | KDM4ECYP2C19DRD2DRD3ADRA1D | |
| SCHEMBL26128296 | 0.76 | CHRM2 (0.45) | KDM4ECYP11B2GPR119CHRM4LMNA | |
| SCHEMBL17723297 | 0.76 | CYP11B2 (0.42) | CYP11B2 |
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-107074838-A | Compound with GPR119 agonist activities, prepare its method and comprising its pharmaceutical composition as active principle | 东亚ST株式会社 | 2017-08-18 | — | — | CN | disclosed |