Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPSE | Q9Y251 | 9/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | VSIR | Q9H7M9 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GRK5 | P34947 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21890973 | 0.90 | VSIR (0.39) | HPSEHDAC6VSIRHPGDGAA | |
| SCHEMBL21890996 | 0.86 | ALDH1A1 (0.41) | HPSEHDAC6ESR1ESR2ALDH1A1 | |
| SCHEMBL21890974 | 0.86 | ESR1 (0.44) | VSIRESR1ESR2ALDH1A1MAPT | |
| SCHEMBL21890975 | 0.86 | MAPT (0.44) | HPSEHDAC6ESR1ESR2ALDH1A1 | |
| SCHEMBL21890995 | 0.86 | ALDH1A1 (0.42) | HPSEESR1ESR2ALDH1A1MAPT | |
| SCHEMBL21890997 | 0.85 | ALDH1A1 (0.44) | ESR1ESR2ALDH1A1MAPTHPGD | |
| SCHEMBL21890999 | 0.83 | ALDH1A1 (0.43) | HPSEESR1ESR2ALDH1A1MAPT | |
| SCHEMBL21891131 | 0.83 | HPSE (0.38) | HPSEHDAC6VSIRESR1ESR2 | |
| SCHEMBL21890963 | 0.81 | ALDH1A1 (0.45) | HPSEESR1ESR2ALDH1A1MAPT | |
| SCHEMBL21890940 | 0.81 | ALDH1A1 (0.45) | HPSEESR1ESR2ALDH1A1MAPT |
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 |