Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.72 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11266594 | 0.94 | KCNH2 (0.80) | KCNH2CHRNA7GAAMAPTL3MBTL1 | |
| SCHEMBL9689872 | 0.88 | KCNH2 (0.90) | KCNH2GAAMAPTL3MBTL1TP53 | |
| SCHEMBL1101038 | 0.85 | KCNH2 (0.77) | KCNH2CHRNA7DNMT3ASSTR5TSHR | |
| SCHEMBL3748349 | 0.84 | KCNH2 (0.63) | KCNH2GAAMAPTL3MBTL1TP53 | |
| SCHEMBL9691007 | 0.84 | KCNH2 (0.59) | KCNH2RAB9A | |
| SCHEMBL9538063 | 0.83 | KCNH2 (1.00) | KCNH2GAAMAPTL3MBTL1TP53 | |
| SCHEMBL9689110 | 0.81 | KCNH2 (0.57) | KCNH2CHRNA7GAAMAPTL3MBTL1 | |
| SCHEMBL9690409 | 0.81 | KCNH2 (0.55) | KCNH2CHRNA7GAARAB9ASMN1; SMN2 | |
| SCHEMBL662101 | 0.80 | PARP1 (0.64) | KCNH2CHRNA7GRIN2BGRIN1PARP1 | |
| SCHEMBL9698375 | 0.80 | KCNH2 (0.66) | KCNH2CHRNA7SMN1; SMN2GRIN2BJAK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0297661-B1 | [(Bicyclic heterocyclyl)methyl and -hetero] substituted hexahydro-1H-azepines and pyrrolidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-09-16 | — | — | EP | disclosed |