Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.35 |
| ▸ | FABP1 | P07148 | 1/20 | 0.32 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038370 | 0.94 | ABCG2 (0.34) | ABCG2ABCB1KDM1AABCC1FABP1 | |
| SCHEMBL25036060 | 0.93 | ABCG2 (0.36) | ABCG2ABCB1KDM1AABCC1FABP1 | |
| SCHEMBL25037887 | 0.92 | ABCG2 (0.37) | ABCG2ABCB1KDM1AABCC1GABRA1 | |
| SCHEMBL25038490 | 0.90 | ABCG2 (0.35) | ABCG2ABCB1KDM1AABCC1GABRA1 | |
| SCHEMBL25038365 | 0.89 | ADORA2A (0.35) | KDM1ASSTR2GABRA1GABRG2GABRB3 | |
| SCHEMBL25038666 | 0.87 | MEN1 (0.32) | SSTR2GABRA1GABRG2GABRB3GABRA2 | |
| SCHEMBL25037999 | 0.87 | SSTR2 (0.34) | SSTR2GABRA1GABRG2GABRB3GABRA2 | |
| SCHEMBL25038607 | 0.86 | ABCG2 (0.37) | ABCG2ABCB1ABCC1GABRA1GABRG2 | |
| SCHEMBL25037991 | 0.86 | SSTR2 (0.33) | SSTR2GABRA1GABRG2GABRB3GABRA2 | |
| SCHEMBL25036035 | 0.85 | ABCG2 (0.36) | ABCG2ABCB1KDM1AABCC1GABRA1 |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |