Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | DRD1 | P21728 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | SSTR1 | P30872 | 2/20 | 0.32 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.32 |
| ▸ | HTR1A | P08908 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7913546 | 0.95 | DRD2 (0.37) | DRD2HTR1DHTR1BDRD1DRD3 | |
| SCHEMBL7913981 | 0.87 | DRD2 (0.35) | DRD2HTR1DHTR1BDRD1DRD3 | |
| SCHEMBL5836573 | 0.85 | DRD2 (0.40) | DRD2HTR1DHTR1BDRD1DRD3 | |
| SCHEMBL5836563 | 0.85 | DRD2 (0.40) | DRD2HTR1DHTR1BDRD1DRD3 | |
| SCHEMBL8834211 | 0.79 | CYP2C9 (0.37) | CYP2C9 | |
| SCHEMBL7911914 | 0.79 | CYP2C9 (0.37) | CYP2C9USP2 | |
| SCHEMBL7914004 | 0.79 | CYP2C9 (0.37) | CYP2C9 | |
| SCHEMBL7914087 | 0.79 | CYP2C9 (0.43) | DRD2DRD1DRD3DRD4DRD5 | |
| SCHEMBL7912009 | 0.79 | CYP2C9 (0.43) | DRD2DRD1DRD3DRD4DRD5 | |
| SCHEMBL8726207 | 0.78 | HCRTR2 (0.39) | DRD2HTR1DHTR1BDRD1DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640578-A1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | Chisso Corporation (JP) | 1995-03-01 | — | — | EP | disclosed |