Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | FPR2 | P25090 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.36 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 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 | |
|---|---|---|---|---|
| SCHEMBL21609930 | 0.91 | KDM1A (0.46) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL15681366 | 0.91 | CYP3A4 (0.43) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL16769035 | 0.90 | CYP3A4 (0.41) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL9015050 | 0.89 | FASN (0.45) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL16769036 | 0.87 | KDM1A (0.40) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL8932591 | 0.86 | KDM1A (0.40) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL12999669 | 0.86 | FASN (0.43) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL8932667 | 0.85 | KDM1A (0.39) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL8933414 | 0.84 | KDM1A (0.39) | CYP3A4CYP2C9APPKDM1AFPR2 | |
| SCHEMBL8932686 | 0.83 | KDM1A (0.38) | CYP3A4CYP2C9APPKDM1AFPR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |