Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 12/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL23936829 | 0.87 | PDK2 (0.46) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL2239449 | 0.83 | PDK2 (0.52) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL30341830 | 0.83 | PDK2 (0.52) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL19757718 | 0.82 | PDK2 (0.60) | PDK2THRBTDP1ALDH1A1CA1 | |
| SCHEMBL26438412 | 0.82 | PDK2 (0.51) | PDK2THRBTDP1CA1CA2 | |
| SCHEMBL27661545 | 0.82 | PDK2 (0.44) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL18383337 | 0.77 | PDK2 (0.44) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL21842337 | 0.77 | PDK2 (0.56) | PDK2THRBTDP1ALDH1A1HSP90AA1 | |
| SCHEMBL283246 | 0.77 | HTR2A (0.48) | PDK2THRBTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL4325901 | 0.77 | PDK2 (0.56) | PDK2THRBTDP1ALDH1A1HSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20210328150-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE | DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) | 2021-10-21 | — | — | US | disclosed |