Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2221806 | 0.80 | HPGD (0.41) | HPGDALDH1A1TDP1S100A4PTPRC | |
| SCHEMBL18967848 | 0.79 | S100A4 (0.56) | HPGDALDH1A1TDP1S100A4PTPRC | |
| SCHEMBL16174634 | 0.77 | S100A4 (0.50) | HPGDALDH1A1TDP1S100A4PTPRC | |
| SCHEMBL4583256 | 0.76 | ALDH1A1 (0.59) | HPGDALDH1A1TDP1S100A4PTPRC | |
| SCHEMBL27756532 | 0.73 | S100A4 (0.50) | HPGDALDH1A1TDP1S100A4PTPRC | |
| SCHEMBL14975560 | 0.73 | CYP2A6 (0.46) | HPGDALDH1A1TDP1PTPRCMAPT | |
| Water SCHEMBL27555216 | 0.73 | HPGD (0.60) | HPGDALDH1A1TDP1MAPTLMNA | |
| SCHEMBL20276535 | 0.73 | S100A4 (0.62) | HPGDALDH1A1TDP1S100A4PTPRC | |
| Ammonia Solution, Strong SCHEMBL28231937 | 0.71 | HPGD (0.58) | HPGDALDH1A1TDP1MAPTLMNA | |
| SCHEMBL18967849 | 0.71 | S100A4 (0.51) | HPGDALDH1A1TDP1S100A4PTPRC |
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 |
|---|---|---|---|---|---|---|---|
| CN-105793779-A | Molecular glass mixtures for organic electronics applications | 分子玻璃公司 | 2016-07-20 | — | — | CN | disclosed |