Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.35 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL26490614 | 0.91 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL314840 | 0.87 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL21699683 | 0.85 | ALDH1A1 (0.38) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL24836882 | 0.85 | ALDH1A1 (0.41) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL17733321 | 0.83 | ALDH1A1 (0.55) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL24553505 | 0.83 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B | |
| SCHEMBL22079547 | 0.83 | GSTP1 (0.48) | ALDH1A1HSD17B10ADORA2AADORA1GSTP1 | |
| SCHEMBL22079070 | 0.83 | GSTP1 (0.48) | ALDH1A1HSD17B10ADORA2AADORA1GSTP1 | |
| SCHEMBL22079069 | 0.83 | GSTP1 (0.48) | ALDH1A1HSD17B10ADORA2AADORA1GSTP1 | |
| SCHEMBL18333532 | 0.82 | ALDH1A1 (0.32) | ALDH1A1CYP3A4HPGDHSD17B10CDC25B |
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-2023003403-A1 | ORGANIC LIGHT-EMITTING DEVICE | 주식회사 엘지화학 | 2023-01-26 | — | — | WO | disclosed |