Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | TYR | P14679 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | SHBG | P04278 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3914426 | 0.84 | BCHE (0.41) | BCHETYRACHECYP17A1SHBG | |
| SCHEMBL27677106 | 0.77 | CYP17A1 (0.60) | BCHETYRACHECYP17A1SHBG | |
| SCHEMBL23003618 | 0.75 | TSHR (0.53) | BCHETYRACHECYP17A1ALDH1A1 | |
| SCHEMBL13126150 | 0.74 | CYP17A1 (0.42) | ACHECYP17A1ALDH1A1HPGDMAPT | |
| Ammonia Solution, Strong SCHEMBL6001231 | 0.72 | CYP17A1 (0.41) | ACHECYP17A1ALDH1A1HPGDMAPT | |
| SCHEMBL360080 | 0.69 | LMNA (0.46) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL17802355 | 0.69 | LMNA (0.46) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL5082590 | 0.68 | SHBG (0.66) | BCHETYRACHECYP17A1SHBG | |
| SCHEMBL3190368 | 0.68 | BCHE (0.45) | BCHETYRACHECYP17A1SHBG | |
| SCHEMBL23055121 | 0.68 | AGBL2 (0.38) | BCHETYRACHECYP17A1ALDH1A1 |
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-100364160-C | Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell | TORAY INDUSTRIES (JP) | 2008-01-23 | — | — | CN | disclosed |