Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25544509 | 0.86 | NISCH (0.33) | CYP1A2CYP2A6HSD17B1HSD17B2 | |
| SCHEMBL27380388 | 0.82 | NOS2 (0.38) | P2RX7NOS2HSD17B1HSD17B2MAPT | |
| SCHEMBL24594461 | 0.81 | P2RX7 (0.38) | P2RX7NOS2MAPT | |
| SCHEMBL15683886 | 0.81 | TP53 (0.39) | P2RX7NOS2TP53MAPT | |
| SCHEMBL26690553 | 0.81 | P2RX7 (0.40) | P2RX7NOS2TP53MAPT | |
| SCHEMBL18729777 | 0.81 | P2RX7 (0.35) | P2RX7NOS2 | |
| SCHEMBL15860723 | 0.81 | CYP1A2 (0.39) | CYP1A2P2RX7NOS2TP53MAPT | |
| SCHEMBL18903112 | 0.81 | P2RX7 (0.35) | P2RX7NOS2 | |
| SCHEMBL27337678 | 0.81 | P2RX7 (0.35) | P2RX7NOS2 | |
| SCHEMBL27381105 | 0.81 | NOS2 (0.36) | CYP1A2P2RX7NOS2HSD17B1HSD17B2 |
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-2021210910-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-10-21 | — | — | WO | disclosed |