Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FASN | P49327 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | APP | P05067 | 2/20 | 0.37 |
| ▸ | FPR2 | P25090 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 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 | |
|---|---|---|---|---|
| SCHEMBL12999661 | 0.96 | FASN (0.40) | FASNKDM1ACYP3A4CYP2C9APP | |
| SCHEMBL172438 | 0.91 | ESR2 (0.42) | FASNKDM1ACYP3A4CYP2C9APP | |
| SCHEMBL12437068 | 0.90 | ESR2 (0.41) | KDM1ACYP3A4CYP2C9APPFPR2 | |
| SCHEMBL9015050 | 0.88 | FASN (0.45) | FASNKDM1ACYP3A4CYP2C9APP | |
| SCHEMBL12658799 | 0.88 | KDM1A (0.38) | FASNKDM1AFPR2ESR2NR3C1 | |
| SCHEMBL15256090 | 0.87 | CYP3A4 (0.42) | FASNKDM1ACYP3A4CYP2C9APP | |
| SCHEMBL802726 | 0.86 | PTGS2 (0.43) | KDM1AFPR2ESR2PTGS2TGFBR1 | |
| SCHEMBL10030943 | 0.86 | PTGS2 (0.43) | KDM1AFPR2ESR2PTGS2TGFBR1 | |
| SCHEMBL8933316 | 0.86 | KDM1A (0.35) | FASNKDM1ACYP3A4CYP2C9APP | |
| SCHEMBL12999669 | 0.85 | FASN (0.43) | FASNKDM1ACYP3A4CYP2C9APP |
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-2206695-A1 | TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | Chisso Corporation (JP) | 2010-07-14 | — | — | EP | disclosed |