Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16158736 | 0.97 | BACE1 (0.39) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16158762 | 0.93 | NR1H4 (0.38) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16158692 | 0.92 | BACE1 (0.39) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16158681 | 0.86 | MEN1 (0.44) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16158656 | 0.84 | NPC1 (0.43) | BACE1NPC1RAB9ACYP1A2MAPT | |
| SCHEMBL16716630 | 0.83 | NPC1 (0.40) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16158686 | 0.83 | BACE1 (0.43) | BACE1CTSDNPC1SMN1; SMN2RAB9A | |
| SCHEMBL16785906 | 0.81 | L3MBTL1 (0.41) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL19368845 | 0.81 | CTSD (0.30) | BACE1CTSD | |
| SCHEMBL16158689 | 0.81 | MEN1 (0.41) | BACE1CTSDNPC1SMN1; SMN2RAB9A |
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 |