Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.39 |
| ▸ | NPC1 | O15118 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HPGD | P15428 | 7/20 | 0.39 |
| ▸ | RAB9A | P51151 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22736042 | 0.98 | KDM4E (0.41) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736441 | 0.96 | KDM4E (0.38) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736062 | 0.96 | NPC1 (0.38) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736548 | 0.96 | KDM4E (0.39) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736419 | 0.95 | NPC1 (0.38) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736400 | 0.94 | NPC1 (0.36) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736626 | 0.93 | KDM4E (0.41) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736763 | 0.92 | VSIR (0.40) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736624 | 0.92 | KDM4E (0.40) | KDM4ENPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL22736443 | 0.92 | KDM4E (0.41) | KDM4ENPC1ALDH1A1HPGDRAB9A |
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-2020242161-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-12-03 | — | — | WO | disclosed |