Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL7902057 | 1.00 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7901817 | 0.96 | CYP1A2 (0.45) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7901810 | 0.96 | CYP1A2 (0.45) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL2385898 | 0.96 | CYP1A2 (0.45) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL9031351 | 0.96 | CYP1A2 (0.45) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7909781 | 0.94 | CYP1A2 (0.43) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7902017 | 0.94 | CYP1A2 (0.43) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7902046 | 0.94 | CYP1A2 (0.43) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7902021 | 0.94 | CYP1A2 (0.43) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL7912162 | 0.94 | CYP1A2 (0.43) | CYP1A2HTTLMNAMAPK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0750028-B1 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORP (JP) | 2001-04-18 | — | — | EP | disclosed |
| US-5776367-A | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORPORATION (JP) | 1998-07-07 | — | — | US | disclosed |
| EP-0750028-A2 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | Chisso Corporation (JP) | 1996-12-27 | — | — | EP | disclosed |