Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3268433 | 0.92 | EPHX1 (0.37) | THRBALDH1A1TSHREPHX1NAAA | |
| SCHEMBL21761419 | 0.87 | EPHX1 (0.34) | EPHX1NAAA | |
| SCHEMBL342182 | 0.86 | ALDH1A1 (0.46) | THRBALDH1A1TSHREPHX1NAAA | |
| SCHEMBL25278 | 0.86 | — | — | |
| SCHEMBL372980 | 0.86 | ALDH1A1 (0.46) | THRBALDH1A1TSHREPHX1NAAA | |
| SCHEMBL27508235 | 0.85 | CYP19A1 (0.40) | ALDH1A1EPHX1NAAA | |
| SCHEMBL7022735 | 0.85 | EPHX1 (0.43) | ALDH1A1EPHX1NAAA | |
| SCHEMBL27529211 | 0.85 | EPHX1 (0.47) | ALDH1A1TSHREPHX1NAAA | |
| SCHEMBL29117656 | 0.83 | EPHX1 (0.50) | ALDH1A1TSHREPHX1NAAA | |
| SCHEMBL29117755 | 0.83 | EPHX1 (0.50) | ALDH1A1TSHREPHX1NAAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019233913-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2019-12-12 | — | — | WO | disclosed |
| WO-2019154740-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2019-08-15 | — | — | WO | disclosed |
| WO-2018073159-A2 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2018-04-26 | — | — | WO | disclosed |