Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.55 |
| ▸ | ACR | P10323 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.54 |
| ▸ | RELA | Q04206 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11299348 | 0.97 | LMNA (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11294239 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11298386 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11298650 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11293806 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL8709685 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL8451854 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11296728 | 0.96 | NPC1 (0.60) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11294252 | 0.95 | MAPT (0.53) | LMNANPC1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL11299893 | 0.90 | MAPT (0.55) | LMNANPC1SMN1; SMN2MAPTKMT2A |
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-0022882-B1 | ANISOTROPIC CARBOXYLIC-ACID-4-CYCLOHEXYLPHENYL ESTERS AND MIXTURES OF LIQUID CRYSTALS CONTAINING THEM | MERCK PATENT GmbH (DE) | 1982-12-15 | — | — | EP | disclosed |
| EP-0022882-A1 | Anisotropic carboxylic-acid-4-cyclohexylphenyl esters and mixtures of liquid crystals containing them | MERCK PATENT GmbH (DE) | 1981-01-28 | — | — | EP | disclosed |