Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30629030 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL24060811 | 0.95 | ALDH1A1 (0.46) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL23624434 | 0.91 | ALDH1A1 (0.39) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL25582006 | 0.87 | PDK2 (0.45) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL26519970 | 0.85 | NPC1 (0.37) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL12133791 | 0.84 | MEN1 (0.38) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL13708976 | 0.84 | RAB9A (0.36) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL13709017 | 0.84 | PDK2 (0.41) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL13708978 | 0.84 | PDK2 (0.41) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL12978474 | 0.83 | CYP2D6 (0.35) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112250585-B | Hole transport material and organic electroluminescent device using same | 南京高光半导体材料有限公司 | 2023-11-14 | — | — | CN | disclosed |
| CN-112250585-A | Hole transport material and organic electroluminescent device using same | 南京高光半导体材料有限公司 | 2021-01-22 | — | — | CN | disclosed |