Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 3/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.32 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.32 |
| ▸ | KDR | P35968 | 2/20 | 0.32 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 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 | |
|---|---|---|---|---|
| SCHEMBL23944933 | 0.86 | CYP1A2 (0.33) | CYP1A2CYP2A6HSD17B1HSD17B2 | |
| SCHEMBL21667532 | 0.85 | NISCH (0.36) | NISCHCYP1A2 | |
| SCHEMBL27382195 | 0.83 | NISCH (0.37) | NISCHCYP1A2EGFRERBB2HSD17B1 | |
| SCHEMBL27382116 | 0.83 | NISCH (0.37) | NISCHCYP1A2EGFRERBB2HSD17B1 | |
| SCHEMBL21667464 | 0.83 | NISCH (0.38) | NISCHCYP1A2HSD17B1HSD17B2 | |
| SCHEMBL27381444 | 0.82 | NISCH (0.38) | NISCHCYP1A2EGFRERBB2HSD17B1 | |
| SCHEMBL27382259 | 0.82 | GSTP1 (0.33) | NISCHCYP1A2 | |
| SCHEMBL24030625 | 0.81 | CYP1B1 (0.34) | PTGESCYP1A2EGFRERBB2ERBB3 | |
| SCHEMBL24292487 | 0.81 | CYP1B1 (0.33) | NISCHCYP1A2 | |
| SCHEMBL24292530 | 0.81 | HSD17B1 (0.38) | NISCHCYP1A2SLC6A2HSD17B1HSD17B2 |
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-2023085908-A1 | ORGANIC LIGHT EMITTING DEVICE | 주식회사 엘지화학 | 2023-05-19 | — | — | WO | disclosed |