Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.34 |
| ▸ | CYP26B1 | Q9NR63 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | PON1 | P27169 | 1/20 | 0.31 |
| ▸ | GNRHR | P30968 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23439359 | 0.86 | CYP26A1 (0.35) | ALDH1A1LMNASMN1; SMN2CYP26A1CYP26B1 | |
| SCHEMBL22936577 | 0.86 | CYP26A1 (0.34) | ALDH1A1CYP26A1CYP26B1MAPTRXRA | |
| SCHEMBL23439367 | 0.86 | LMNA (0.35) | ALDH1A1LMNASMN1; SMN2RXRAGNRHR | |
| SCHEMBL23439452 | 0.86 | ALDH1A1 (0.43) | ALDH1A1LMNASMN1; SMN2MAPTGNRHR | |
| SCHEMBL23439057 | 0.84 | CYP26A1 (0.39) | ALDH1A1CYP26A1CYP26B1MAPTRXRA | |
| SCHEMBL23422190 | 0.81 | CYP26A1 (0.38) | ALDH1A1LMNACYP26A1CYP26B1RXRA | |
| SCHEMBL23439979 | 0.80 | RXRA (0.33) | ALDH1A1LMNASMN1; SMN2CYP26A1CYP26B1 | |
| SCHEMBL23439940 | 0.79 | ALDH1A1 (0.36) | ALDH1A1LMNASMN1; SMN2MAPTGNRHR | |
| SCHEMBL23438785 | 0.78 | ABCG2 (0.30) | — | |
| SCHEMBL31069403 | 0.78 | ABCG2 (0.30) | — |
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-2021107711-A1 | POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |