Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | CLK1 | P49759 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.33 |
| ▸ | CLK3 | P49761 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29315630 | 0.96 | ESR1 (0.37) | ESR1ESR2P2RX7BACE1FGFR1 | |
| SCHEMBL15275975 | 0.92 | NISCH (0.38) | P2RX7NISCHNOS2 | |
| SCHEMBL25523640 | 0.88 | NISCH (0.39) | ESR1ESR2P2RX7CYP11B1CYP11B2 | |
| SCHEMBL23075243 | 0.87 | ESR1 (0.36) | ESR1ESR2BACE1CYP11B1CYP11B2 | |
| SCHEMBL18808569 | 0.85 | NISCH (0.39) | ESR1ESR2CYP11B1CYP11B2NISCH | |
| SCHEMBL24037118 | 0.83 | P2RX7 (0.42) | P2RX7NISCHNOS2NPC1 | |
| SCHEMBL22174543 | 0.83 | EGFR (0.36) | P2RX7NPC1 | |
| SCHEMBL18901261 | 0.81 | HSD17B1 (0.37) | ESR1ESR2P2RX7BACE1FGFR1 | |
| SCHEMBL23075240 | 0.81 | P2RX7 (0.37) | P2RX7NISCHNOS2NPC1 | |
| SCHEMBL18561128 | 0.81 | NOS2 (0.36) | ESR2P2RX7NISCHNOS2 |
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-2024144087-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR | 덕산네오룩스 주식회사 | 2024-07-04 | — | — | WO | disclosed |