Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | UCHL1 | P09936 | 2/20 | 0.41 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7734440 | 1.00 | MEN1 (0.46) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL7407543 | 0.93 | NR1H2 (0.41) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL7667825 | 0.93 | NR1H2 (0.41) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL7414541 | 0.93 | NR1H2 (0.41) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL7918530 | 0.87 | HCRTR2 (0.49) | MEN1KMT2AHCRTR2OPRD1KDM1A | |
| SCHEMBL7918528 | 0.87 | HCRTR2 (0.49) | MEN1KMT2AHCRTR2OPRD1KDM1A | |
| SCHEMBL86666 | 0.84 | LMNA (0.47) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL143674 | 0.84 | LMNA (0.47) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL345625 | 0.84 | LMNA (0.47) | MEN1KMT2ALMNANPSR1HCRTR2 | |
| SCHEMBL29407129 | 0.82 | STS (0.51) | MEN1KMT2ANPSR1HCRTR2OPRD1 |
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-111393375-A | Nitrogen-substituted hexabasic aromatic heterocyclic ketone compound and pharmaceutical composition, preparation method and application thereof | 中国药科大学 | 2020-07-10 | — | — | CN | disclosed |