Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VSIR | Q9H7M9 | 6/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 9/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25459696 | 0.94 | VSIR (0.44) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL21890974 | 0.92 | ESR1 (0.44) | VSIRESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL21890976 | 0.92 | HPSE (0.46) | KDM4ENPC1ALDH1A1MAPTHPGD | |
| SCHEMBL25459644 | 0.90 | NPC1 (0.44) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL25459695 | 0.88 | ALOX5 (0.46) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL22736080 | 0.88 | VSIR (0.42) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL21890973 | 0.86 | VSIR (0.39) | VSIRKDM4ENPC1HPGDRAB9A | |
| SCHEMBL23473731 | 0.86 | GPR119 (0.42) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL22736767 | 0.86 | VSIR (0.39) | VSIRESR1ESR2KDM4ENPC1 | |
| SCHEMBL22736765 | 0.86 | VSIR (0.39) | VSIRESR1ESR2KDM4ENPC1 |
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-2020071863-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME | 주식회사 엘지화학 | 2020-04-09 | — | — | WO | disclosed |