Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 10/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL22744945 | 0.95 | PDK2 (0.48) | PDK2ALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL22744886 | 0.88 | PDK2 (0.40) | PDK2ALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL824160 | 0.88 | PDK2 (0.55) | PDK2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL30463510 | 0.88 | PDK2 (0.55) | PDK2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1978583 | 0.88 | PDK2 (0.55) | PDK2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL19164438 | 0.86 | PDK2 (0.54) | PDK2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL19164437 | 0.86 | PDK2 (0.54) | PDK2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24730387 | 0.84 | PDK2 (0.51) | PDK2ALDH1A1THRBTDP1OPRM1 | |
| SCHEMBL22237663 | 0.83 | PDK2 (0.51) | PDK2ALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL24406612 | 0.82 | NPC1 (0.41) | PDK2ALDH1A1NPC1PLA2G1BNFKB1 |
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-2020237835-A1 | SPIROBIFLUORENE ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE | 南京高光半导体材料有限公司 | 2020-12-03 | — | — | WO | disclosed |