Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 9/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | SLC2A2 | P11168 | 1/20 | 0.36 |
| ▸ | SLC2A3 | P11169 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | AKT2 | P31751 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27651256 | 0.85 | CYP3A4 (0.39) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 | |
| SCHEMBL27834955 | 0.80 | NR3C1 (0.38) | NR3C1 | |
| SCHEMBL13762805 | 0.77 | ALOX15 (0.46) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 | |
| SCHEMBL27651255 | 0.77 | CYP3A4 (0.45) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 | |
| Tert-Butyl Formate SCHEMBL28791757 | 0.76 | HTR6 (0.36) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 | |
| SCHEMBL1128265 | 0.76 | CYP3A4 (0.62) | CYP3A4NR3C1CYP2C9 | |
| SCHEMBL28794697 | 0.75 | NR3C1 (0.36) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 | |
| SCHEMBL2075668 | 0.74 | ABL1 (0.47) | NR3C1SLC2A1SLC2A2SLC2A3ABL1 | |
| SCHEMBL2077023 | 0.73 | ABL1 (0.49) | SLC2A1SLC2A2SLC2A3ABL1BCR | |
| SCHEMBL27797039 | 0.72 | NR3C1 (0.38) | CYP3A4NR3C1SLC2A1SLC2A2SLC2A3 |
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-102036991-A | GPR119 receptor agonists | HOFFMANN LA ROCHE | 2011-04-27 | — | — | CN | disclosed |