Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.43 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10272647 | 0.85 | MRGPRX4 (0.64) | MRGPRX4KCNH2LIPGBCHELMNA | |
| SCHEMBL15635448 | 0.83 | MRGPRX4 (0.56) | MRGPRX4KCNH2LIPGBCHELMNA | |
| SCHEMBL9810698 | 0.81 | SLC18A3 (0.44) | CYP2C19GAAMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL5691491 | 0.79 | MAOB (0.62) | MRGPRX4KCNH2LIPGBCHELMNA | |
| SCHEMBL7369690 | 0.79 | MRGPRX4 (0.60) | MRGPRX4KCNH2LIPGLMNACYP1A2 | |
| SCHEMBL12525375 | 0.79 | MRGPRX4 (0.57) | MRGPRX4KCNH2LIPGBCHELMNA | |
| SCHEMBL7369689 | 0.79 | MRGPRX4 (0.60) | MRGPRX4KCNH2LIPGLMNACYP1A2 | |
| SCHEMBL12523729 | 0.79 | MRGPRX4 (0.57) | MRGPRX4KCNH2LIPGBCHELMNA | |
| SCHEMBL5249481 | 0.78 | HRH3 (0.60) | MRGPRX4KCNH2BCHELMNACYP1A2 | |
| SCHEMBL9441348 | 0.78 | MRGPRX4 (0.64) | MRGPRX4KCNH2LIPGLMNACYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0465048-B1 | Carboxylic acid ester compound, liquid crystal compound, liquid crystal composition, liquid crystal element and light modulation method | MITSUI PETROCHEMICAL IND (JP) | 1996-09-11 | — | — | EP | disclosed |
| EP-0465048-A2 | Carboxylic acid ester compound, liquid crystal compound, liquid crystal composition, liquid crystal element and light modulation method | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-01-08 | — | — | EP | disclosed |