Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL27382120 | 0.89 | NISCH (0.39) | NISCHESR1ESR2CYP1A2SMN1; SMN2 | |
| SCHEMBL27382317 | 0.82 | HSD17B1 (0.35) | NISCHESR1ESR2CYP1A2SMN1; SMN2 | |
| SCHEMBL27381887 | 0.81 | P2RX7 (0.38) | NISCHESR1ESR2CYP1A2SMN1; SMN2 | |
| SCHEMBL24356941 | 0.80 | EGFR (0.39) | NISCHESR1ESR2CYP11B1CYP11B2 | |
| SCHEMBL23947222 | 0.79 | MEN1 (0.34) | NISCHCYP1A2 | |
| SCHEMBL19534165 | 0.79 | P2RX7 (0.38) | CYP1A2 | |
| SCHEMBL19534134 | 0.78 | P2RX7 (0.38) | — | |
| SCHEMBL25823385 | 0.78 | CA12 (0.38) | SMN1; SMN2 | |
| SCHEMBL19071578 | 0.77 | AURKA (0.32) | NISCHCYP1A2NR1H4 | |
| SCHEMBL19622662 | 0.77 | NISCH (0.36) | NISCH |
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-2017188596-A1 | ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 주식회사 두산 | 2017-11-02 | — | — | WO | disclosed |