Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CDC25B | P30305 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL19227577 | 0.90 | ALDH1A1 (0.33) | ALDH1A1SMN1; SMN2CDC25BHPGDALOX15 | |
| SCHEMBL7065615 | 0.79 | TSHR (0.57) | SMN1; SMN2HTTMAPT | |
| SCHEMBL13822493 | 0.79 | GRIN2D (0.33) | ALDH1A1SMN1; SMN2CDC25BGRIN2DGRIN3B | |
| SCHEMBL7063876 | 0.72 | TSHR (0.63) | ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL7062871 | 0.72 | TSHR (0.62) | ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1 | |
| SCHEMBL1760720 | 0.71 | TSHR (0.50) | ALDH1A1CDC25BALOX15GRIN2DGRIN3B | |
| SCHEMBL1795462 | 0.71 | GRIN2D (0.48) | ALDH1A1CDC25BGRIN2DGRIN3BGRIN1 | |
| SCHEMBL24774025 | 0.70 | TSHR (0.60) | ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL24772918 | 0.70 | TSHR (0.60) | ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL28303303 | 0.69 | CDC25B (0.43) | ALDH1A1CDC25BGRIN2DGRIN3BGRIN1 |
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-1888707-B1 | NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES | MERCK PATENT GMBH (DE) | 2017-08-09 | — | — | EP | disclosed |