Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.44 |
| ▸ | PPARG | P37231 | 7/20 | 0.40 |
| ▸ | PPARA | Q07869 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21336514 | 0.83 | THRB (0.46) | THRBPPARGPPARAALDH1A1CYP3A4 | |
| SCHEMBL17791310 | 0.82 | THRB (0.62) | THRBPPARGALDH1A1CYP3A4TSHR | |
| SCHEMBL22298168 | 0.81 | THRB (0.44) | THRBALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL2241842 | 0.81 | THRB (0.59) | THRBPPARAALDH1A1CYP3A4TSHR | |
| SCHEMBL20653366 | 0.81 | HTT (0.55) | THRBALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL19789587 | 0.81 | THRB (0.39) | THRBTSHR | |
| SCHEMBL23487534 | 0.81 | HTT (0.44) | THRBALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL14907483 | 0.81 | THRB (0.46) | THRBPPARGALDH1A1CYP3A4TSHR | |
| SCHEMBL23125520 | 0.80 | THRB (0.45) | THRBALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL20653354 | 0.80 | NPC1 (0.43) | THRBALDH1A1CYP3A4TSHRHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2771735-B1 | SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-01-24 | — | — | EP | disclosed |