Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.63 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.56 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.56 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL4105526 | 0.92 | DGAT1 (0.62) | PARP1KCNH2DGAT1SOAT1 | |
| SCHEMBL28034104 | 0.84 | PARP1 (0.61) | PARP1 | |
| SCHEMBL28033633 | 0.79 | HDAC6 (0.46) | PARP1KCNH2DGAT1SOAT1 | |
| SCHEMBL28034096 | 0.79 | PARP1 (0.46) | PARP1KCNH2DGAT1SOAT1 | |
| SCHEMBL6717209 | 0.78 | KCNH2 (0.52) | KCNH2 | |
| SCHEMBL4105474 | 0.78 | MAPT (0.67) | — | |
| SCHEMBL4105380 | 0.78 | ADRB1 (0.56) | — | |
| SCHEMBL16363644 | 0.77 | PARP1 (1.00) | PARP1 | |
| SCHEMBL28034094 | 0.77 | PARP1 (0.63) | PARP1 | |
| SCHEMBL4113178 | 0.75 | NPY5R (0.53) | KCNH2 |
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-104981468-A | Benzimidazole-2-piperazine heterocyclic compound, pharmaceutical composition thereof, preparation method and use thereof | SHANGHAI HUILUN LIFE SCIENCE & TECHNOLOGY CO LTD | 2015-10-14 | — | — | CN | disclosed |