Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.35 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.34 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24628242 | 1.00 | ALDH1A1 (0.38) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A | |
| SCHEMBL24628249 | 0.94 | ALDH1A1 (0.42) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A | |
| SCHEMBL24628544 | 0.92 | PLA2G2A (0.40) | ALDH1A1KDM4EHSD17B10KMT2ATP53 | |
| SCHEMBL24628554 | 0.91 | PLA2G2A (0.39) | ALDH1A1KDM4EHSD17B10KMT2ATP53 | |
| SCHEMBL24628321 | 0.91 | PLA2G2A (0.39) | ALDH1A1KDM4EHSD17B10KMT2ATP53 | |
| SCHEMBL24628876 | 0.91 | ALDH1A1 (0.36) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A | |
| SCHEMBL24628236 | 0.90 | CYP1A2 (0.43) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A | |
| SCHEMBL24628815 | 0.88 | MEN1 (0.38) | ALDH1A1KDM4EKMT2AMEN1PLA2G2A | |
| SCHEMBL24628243 | 0.87 | CYP1A2 (0.40) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A | |
| SCHEMBL26271373 | 0.86 | ALDH1A1 (0.41) | ALDH1A1KDM4EHSD17B10CYP1A2KMT2A |
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-2022148717-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-07-14 | — | — | WO | disclosed |