Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24302110 | 0.81 | CYP2D6 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL1492823 | 0.81 | CYP2D6 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL21858220 | 0.79 | TAAR1 (0.54) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL7886997 | 0.79 | ESR1 (0.46) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL3240819 | 0.78 | CYP2D6 (0.44) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL6253277 | 0.78 | CYP2D6 (0.41) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL194642 | 0.77 | CCR1 (0.47) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL5779039 | 0.76 | ALDH1A1 (0.46) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL9184336 | 0.76 | ESR1 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL17593727 | 0.76 | CYP2D6 (0.40) | CYP2D6DRD2DRD4OPRM1DRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1215030-C | 1,4-diaryl-2-fluoro-2-butene insecticidal and acaricidal agents | AMERICAN CYANAMID CO (US) | 2005-08-17 | — | — | CN | disclosed |
| CN-1236612-A | Methods and compositions for protecting animals and humans against attack and infestation by arthropod and helminth parasites | AMERICAN CYANAMID CO (US) | 1999-12-01 | — | — | CN | disclosed |
| CN-1167105-A | 1,4-diaryl-2-fluoro-2-butene insecticidal and acaricidal agents | AMERICAN CYANAMID CO (US) | 1997-12-10 | — | — | CN | disclosed |