Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.64 |
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17791310 | 0.95 | THRB (0.62) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL17036974 | 0.95 | THRB (0.62) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL8031169 | 0.95 | THRB (0.62) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL3901525 | 0.91 | THRB (0.66) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL14329709 | 0.91 | THRB (0.57) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL28297899 | 0.91 | THRB (0.60) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL12219943 | 0.90 | THRB (0.59) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL3440797 | 0.90 | THRB (0.69) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL14088554 | 0.90 | THRB (0.54) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL1067437 | 0.90 | THRB (0.56) | THRBTSHRALDH1A1CYP3A4HPGD |
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-3548586-B1 | POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH FLAT OPTICAL DISPERSION | MERCK PATENT GMBH (DE) | 2020-09-23 | — | — | EP | disclosed |