Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 7/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | PRCP | P42785 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | APLNR | P35414 | 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 | |
|---|---|---|---|---|
| SCHEMBL28024911 | 0.86 | GPR119 (0.40) | DRD4GPR119OPRL1SLC6A3CYP3A4 | |
| SCHEMBL27790080 | 0.83 | RBP4 (0.46) | GPR119MAPTOPRL1SLC6A2SLC6A4 | |
| SCHEMBL28146205 | 0.79 | RBP4 (0.48) | OPRL1SLC6A3CYP3A4CYP2C9SLC9A1 | |
| SCHEMBL28146200 | 0.78 | RBP4 (0.50) | — | |
| SCHEMBL28146207 | 0.78 | RBP4 (0.48) | CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28024448 | 0.77 | OPRL1 (0.36) | DRD4LMNAMAPTTHRBOPRL1 | |
| SCHEMBL28147246 | 0.76 | RBP4 (0.49) | CYP3A4CYP2C9SLC9A1CYP2C19KCNH2 | |
| SCHEMBL27704480 | 0.75 | DRD2 (0.46) | GPR119DRD2KCNH2 | |
| SCHEMBL28766839 | 0.74 | MAPT (0.40) | DRD4DRD2DRD3MAPTPTGDR2 | |
| SCHEMBL14924438 | 0.74 | OPRL1 (0.46) | DRD4OPRL1SLC6A2SLC6A4SLC6A3 |
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-101778831-A | Novel piperazine amide derivatives | HOFFMANN LA ROCHE | 2010-07-14 | — | — | CN | disclosed |