Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 4/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 5/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7563208 | 0.84 | CES2 (0.41) | CES2TSHRCES1CYP4F2CYP4A11 | |
| SCHEMBL7263038 | 0.83 | CES2 (0.39) | CES2TSHRCES1FAAHMEN1 | |
| SCHEMBL12762074 | 0.81 | THRB (0.46) | THRB | |
| SCHEMBL7262111 | 0.80 | CES2 (0.49) | CES2CES1FAAHMEN1KMT2A | |
| SCHEMBL7563945 | 0.78 | CES1 (0.43) | CES2TSHRCES1CYP4F2CYP4A11 | |
| SCHEMBL7560000 | 0.77 | CES2 (0.35) | CES2TSHRCES1FAAHMEN1 | |
| SCHEMBL7558635 | 0.75 | CES2 (0.35) | CES2TSHRCES1CYP3A4 | |
| Trifluoroacetic Acid SCHEMBL28053749 | 0.75 | CES2 (0.55) | CES2TSHRCES1FAAHMEN1 | |
| Trifluoroacetic Acid SCHEMBL29225076 | 0.75 | CES2 (0.66) | CES2CES1FAAHTHRBMEN1 | |
| SCHEMBL12762097 | 0.74 | ACLY (0.37) | CES2THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-5482650-A | Liquid crystal compounds having perfluoroether terminal portions | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-01-09 | — | — | US | disclosed |
| US-5437812-A | Achiral and having low-temperature smectic mesophases or or latent smectic mesophases; used in mixtures with fluorinated liquid crystals; low birefringence and viscosity; high speed switches; stability | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-08-01 | — | — | US | disclosed |