Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | RPS6KB2 | Q9UBS0 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28464383 | 0.85 | ALDH1A1 (0.43) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL28471584 | 0.79 | ALDH1A1 (0.42) | ALDH1A1KMT2AL3MBTL1MEN1LMNA | |
| SCHEMBL29351088 | 0.77 | ALDH1A1 (0.47) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL29351593 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL28877280 | 0.75 | ALDH1A1 (0.45) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL29947855 | 0.75 | ALDH1A1 (0.45) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL28464420 | 0.75 | RPS6KB2 (0.54) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 | |
| SCHEMBL28463638 | 0.74 | TDP1 (0.47) | ALDH1A1KMT2AL3MBTL1MEN1LMNA | |
| SCHEMBL28465392 | 0.73 | NPC1 (0.39) | ALDH1A1KMT2AL3MBTL1MEN1LMNA | |
| SCHEMBL20412242 | 0.71 | NPSR1 (0.51) | ALDH1A1KMT2AL3MBTL1MEN1RPS6KB2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108341806-B | Iridium metal complex, application thereof and organic electroluminescent device | 清华大学 | 2020-09-22 | — | — | CN | disclosed |
| WO-2018133579-A1 | RUTHENIUM METAL COMPLEX, APPLICATIONS THEREOF, AND ORGANIC ELECTROLUMINESCENT COMPONENT | 清华大学 | 2018-07-26 | — | — | WO | disclosed |