Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.45 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.45 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.45 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1193688 | 1.00 | NQO2 (0.57) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL13156532 | 0.95 | NQO2 (0.52) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL13156490 | 0.95 | NQO2 (0.52) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL29726025 | 0.81 | ALDH1A1 (0.61) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL50867 | 0.81 | ALDH1A1 (0.61) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL30372045 | 0.81 | NPC1 (0.58) | ALDH1A1NPC1RAB9APOLBMAPT | |
| SCHEMBL2801533 | 0.81 | NPC1 (0.58) | ALDH1A1NPC1RAB9APOLBMAPT | |
| SCHEMBL20698658 | 0.81 | NQO2 (0.56) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL12532560 | 0.81 | CHRNB4 (0.37) | NQO2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL31733917 | 0.79 | ALDH1A1 (0.58) | NQO2ALDH1A1NPC1RAB9APOLB |
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-116354973-A | Organic compound, light-emitting device, thin film, light-emitting device, electronic apparatus, and lighting device | 株式会社半导体能源研究所 | 2023-06-30 | — | — | CN | disclosed |