Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16158657 | 0.95 | NPC1 (0.41) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL16158686 | 0.94 | BACE1 (0.43) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL16158681 | 0.94 | MEN1 (0.44) | NPC1RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL16158693 | 0.92 | BACE1 (0.38) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL16158691 | 0.89 | MEN1 (0.49) | MEN1KMT2AL3MBTL1ALDH1A1MAPT | |
| SCHEMBL16158689 | 0.89 | MEN1 (0.41) | NPC1RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL16158802 | 0.89 | MEN1 (0.49) | MEN1KMT2AL3MBTL1ALDH1A1MAPT | |
| SCHEMBL27255495 | 0.87 | MEN1 (0.41) | NPC1RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL16158736 | 0.87 | BACE1 (0.39) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL27290898 | 0.86 | BACE1 (0.38) | NPC1RAB9AMEN1KMT2AL3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2873666-B1 | HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME | LG CHEMICAL LTD (KR) | 2017-09-20 | — | — | EP | disclosed |
| US-9412954-B2 | Heterocyclic compound and organic electronic element containing same | LG CHEM, LTD. (KR) | 2016-08-09 | — | — | US | disclosed |
| US-9412954-B2 | Heterocyclic compound and organic electronic element containing same | LG CHEM, LTD. (KR) | 2016-08-09 | — | — | US | disclosed |
| US-20140299192-A1 | HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME | LG CHEM, LTD. (KR) | 2014-10-09 | — | — | US | disclosed |
| US-20140299192-A1 | HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME | LG CHEM, LTD. (KR) | 2014-10-09 | — | — | US | disclosed |