Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 3/20 | 0.38 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.37 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6950035 | 0.89 | TSHR (0.41) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 | |
| SCHEMBL6954941 | 0.89 | TSHR (0.41) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 | |
| SCHEMBL7882595 | 0.86 | CYP3A4 (0.47) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 | |
| SCHEMBL8970306 | 0.84 | CYP2D6 (0.56) | CYP3A4CYP2D6KDM4EALDH1A1HPGD | |
| SCHEMBL7883759 | 0.83 | NR5A1 (0.56) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 | |
| SCHEMBL9082520 | 0.82 | CYP2D6 (0.49) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 | |
| SCHEMBL9506174 | 0.82 | CYP2D6 (0.57) | CYP3A4CYP2D6KDM4EALDH1A1HPGD | |
| SCHEMBL9506148 | 0.82 | CYP2D6 (0.57) | CYP3A4CYP2D6KDM4EALDH1A1HPGD | |
| SCHEMBL9720092 | 0.81 | MAPT (0.52) | CYP3A4CYP2D6KDM4EALDH1A1HPGD | |
| SCHEMBL21094226 | 0.81 | CYP3A4 (0.45) | CYP3A4CYP2D6SOAT1KDM4EALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1208182-B1 | SMECTIC LIQUID CRYSTAL HIGH-CONTRAST CONTROL OR DISPLAY DEVICE | CLARIANT INT LTD (CH) | 2004-02-25 | — | — | EP | claimed |
| US-7019811-B1 | Smectic liquid crystal high-contrast control or display device | CLARIANT INTERNATIONAL, LTD. (CH) | 2006-03-28 | — | — | US | disclosed |
| EP-0639189-B1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | AVENTIS RES & TECH GMBH & CO (DE) | 2003-02-19 | — | — | EP | disclosed |
| WO-1992012974-A1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-08-06 | — | — | WO | disclosed |