Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL22150982 | 0.93 | PDK2 (0.41) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL16858246 | 0.92 | PDK2 (0.44) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL19151976 | 0.88 | ALDH1A1 (0.42) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL22125456 | 0.88 | PDK2 (0.45) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL29435804 | 0.88 | PDK2 (0.45) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL16858243 | 0.86 | PDK2 (0.46) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL16858247 | 0.84 | PDK2 (0.44) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL29352350 | 0.83 | PDK2 (0.51) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL15550688 | 0.83 | PDK2 (0.51) | PDK2ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL21102596 | 0.81 | PDK2 (0.38) | PDK2TDP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020138945-A1 | COMPOUND, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE | 엘티소재주식회사 | 2020-07-02 | — | — | WO | disclosed |