Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.37 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.37 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21236418 | 0.99 | ABCG2 (0.44) | ABCG2ABCB1MYCGABRA1GABRG2 | |
| SCHEMBL21236427 | 0.95 | ABCG2 (0.44) | ABCG2ABCB1MYCGABRA1GABRG2 | |
| SCHEMBL21236095 | 0.94 | ABCG2 (0.41) | ABCG2ABCB1LMNAABCC1ALDH1A3 | |
| SCHEMBL21236093 | 0.92 | ABCG2 (0.41) | ABCG2ABCB1LMNAABCC1MEN1 | |
| SCHEMBL23730720 | 0.90 | MEN1 (0.44) | KDM4ELMNAMEN1KMT2ANTSR1 | |
| SCHEMBL23730717 | 0.89 | MEN1 (0.46) | KDM4ELMNAMEN1KMT2ANTSR1 | |
| SCHEMBL21236094 | 0.88 | ABCG2 (0.41) | ABCG2ABCB1LMNAABCC1LIMK1 | |
| SCHEMBL23730920 | 0.87 | MEN1 (0.39) | KDM4ELMNALIMK1MEN1KMT2A | |
| SCHEMBL21236408 | 0.87 | ABCG2 (0.36) | ABCG2ABCB1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL23730734 | 0.87 | MEN1 (0.46) | KDM4ELMNAMEN1KMT2ANTSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3527564-B1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME | LG CHEMICAL LTD (KR) | 2022-03-02 | — | — | EP | disclosed |
| EP-3527564-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME | LG Chem, Ltd. (KR) | 2019-08-21 | — | — | EP | disclosed |