Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 7/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | DGKA | P23743 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8962576 | 0.92 | TSHR (0.41) | TSHRALDH1A1HPGDACHETP53 | |
| SCHEMBL8962506 | 0.85 | TSHR (0.40) | TSHRALDH1A1HPGDNAAATHRB | |
| SCHEMBL3081526 | 0.83 | TSHR (0.55) | TSHRALDH1A1HPGDACHETP53 | |
| SCHEMBL5167857 | 0.83 | TSHR (0.60) | TSHRALDH1A1HPGDACHEATM | |
| Hexane SCHEMBL28941486 | 0.83 | TSHR (0.67) | TSHRALDH1A1HPGDACHEATM | |
| Ethylene SCHEMBL27507038 | 0.81 | TSHR (0.53) | TSHRALDH1A1HPGDACHETP53 | |
| SCHEMBL29168696 | 0.81 | TSHR (0.53) | TSHRALDH1A1HPGDACHETP53 | |
| SCHEMBL3478206 | 0.81 | TSHR (0.63) | TSHRALDH1A1HPGDTP53ATM | |
| SCHEMBL170886 | 0.81 | TSHR (0.52) | TSHRALDH1A1HPGDACHETP53 | |
| SCHEMBL3477589 | 0.80 | TSHR (0.67) | TSHRALDH1A1ACHENAAADGKA |
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-5554706-A | LOW TEMPERATURE LIQUID CRYSTALS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1996-09-10 | — | — | US | disclosed |
| EP-0695770-A1 | COPOLYMER HAVING LIQUID CRYSTAL GROUP IN THE SIDE CHAIN | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1996-02-07 | — | — | EP | disclosed |