Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23921174 | 1.00 | ALDH1A1 (0.45) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL15853139 | 0.81 | ALDH1A1 (0.45) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL17500131 | 0.81 | MEN1 (0.50) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL7955330 | 0.80 | ALDH1A1 (0.42) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL1011515 | 0.78 | MAOB (0.50) | ALDH1A1NPC1RAB9AL3MBTL1KEAP1 | |
| SCHEMBL94483 | 0.78 | ALDH1A1 (0.50) | ALDH1A1NPC1PLA2G1BRAB9AL3MBTL1 | |
| SCHEMBL15853161 | 0.77 | AKR1C3 (0.51) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL15853136 | 0.77 | FNTA (0.50) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL29416683 | 0.76 | KIF11 (0.41) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL261123 | 0.76 | KIF11 (0.41) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 |
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-113366002-B | Compound and organic light emitting device including the same | 株式会社LG化学 | 2022-09-27 | — | — | CN | disclosed |