Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | DHPS | P49366 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NQO2 | P16083 | 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 | |
|---|---|---|---|---|
| SCHEMBL20321846 | 0.88 | NPC1 (0.45) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL9108122 | 0.86 | NQO1 (0.47) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL28327203 | 0.83 | RAB9A (0.57) | NPC1RAB9ATP53PTGS2NFE2L2 | |
| SCHEMBL18339168 | 0.82 | ERN1 (0.47) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL30012355 | 0.81 | ERN1 (0.46) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL9106393 | 0.81 | ERN1 (0.46) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL30184927 | 0.80 | DHPS (0.42) | NPC1HTTERN1DHPSRPS6KA2 | |
| SCHEMBL22276545 | 0.80 | DHPS (0.42) | NPC1HTTERN1DHPSRAB9A | |
| SCHEMBL14231759 | 0.77 | NQO1 (0.52) | AXLALDH1A1SMN1; SMN2MAPTNQO2 | |
| SCHEMBL16290565 | 0.77 | NQO1 (0.56) | AXLALDH1A1SMN1; SMN2MAPTNQO2 |
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-110446715-B | Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device | 株式会社半导体能源研究所 | 2022-11-08 | — | — | CN | disclosed |