Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.36 |
| ▸ | KCNK18 | Q7Z418 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TOP2A | P11388 | 2/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31069384 | 1.00 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1LMNAABCG2KCNK18 | |
| SCHEMBL31069466 | 0.95 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1LMNAABCG2KCNK18 | |
| SCHEMBL31069400 | 0.95 | SMN1; SMN2 (0.41) | ALDH1A1L3MBTL1LMNAABCG2MAPT | |
| SCHEMBL23439032 | 0.95 | SMN1; SMN2 (0.41) | ALDH1A1L3MBTL1LMNAABCG2MAPT | |
| SCHEMBL23421832 | 0.94 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1LMNAABCG2KCNK18 | |
| SCHEMBL31069296 | 0.89 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1ABCG2KCNK18MAPT | |
| SCHEMBL23439342 | 0.88 | ALDH1A1 (0.38) | ALDH1A1ABCG2KCNK18MAPTNPC1 | |
| SCHEMBL29640000 | 0.88 | ALDH1A1 (0.38) | ALDH1A1ABCG2KCNK18MAPTNPC1 | |
| SCHEMBL23439666 | 0.88 | ABCG2 (0.34) | ALDH1A1L3MBTL1LMNAABCG2KCNK18 | |
| SCHEMBL31069433 | 0.88 | ABCG2 (0.34) | ALDH1A1L3MBTL1LMNAABCG2KCNK18 |
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 |