Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | IL1R1 | P14778 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | LIG1 | P18858 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 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 | |
|---|---|---|---|---|
| SCHEMBL20706844 | 0.84 | L3MBTL1 (0.65) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL30017427 | 0.84 | L3MBTL1 (0.65) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL14296105 | 0.83 | L3MBTL1 (0.63) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL14296084 | 0.83 | L3MBTL1 (0.63) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL21382459 | 0.83 | L3MBTL1 (0.63) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL14296009 | 0.83 | L3MBTL1 (0.63) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL31325063 | 0.82 | KDM4E (0.53) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL16675303 | 0.80 | KDM4E (0.59) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL29203913 | 0.79 | L3MBTL1 (0.57) | KDM4EATML3MBTL1DUSP3MAPK8 | |
| SCHEMBL17348845 | 0.78 | KDM4E (0.49) | KDM4EATML3MBTL1DUSP3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117143017-A | Method for constructing isoquinoline compound based on aryl migration strategy, hole transport material molecule and preparation method thereof, perovskite solar cell and preparation method thereof | 广东工业大学 | 2023-12-01 | — | — | CN | disclosed |