Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | SCN1A | P35498 | 2/20 | 0.54 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.54 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9591172 | 0.94 | TSHR (0.63) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL14497517 | 0.90 | TSHR (0.59) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL13554252 | 0.89 | TSHR (0.58) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL13474871 | 0.87 | TSHR (0.56) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL7533362 | 0.87 | TSHR (0.75) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL13474879 | 0.86 | TSHR (0.55) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL13554333 | 0.85 | SCN1A (0.56) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL13474857 | 0.85 | TSHR (0.54) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL18948144 | 0.83 | TSHR (0.46) | TSHRSCN1ASCN2ASCN3AALDH1A1 | |
| SCHEMBL7477447 | 0.83 | TSHR (0.61) | TSHRALDH1A1ESR1HSD17B10KMT2A |
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-2855630-B1 | LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY | MERCK PATENT GMBH (DE) | 2017-12-20 | — | — | EP | disclosed |