Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL19088844 | 1.00 | CHRM3 (0.84) | CHRM3ADRB2 | |
| SCHEMBL890834 | 0.92 | CHRM3 (1.00) | CHRM3ADRB2 | |
| SCHEMBL730345 | 0.92 | CHRM3 (1.00) | CHRM3ADRB2 | |
| SCHEMBL730346 | 0.92 | CHRM3 (1.00) | CHRM3ADRB2 | |
| Fluoride SCHEMBL890954 | 0.91 | CHRM3 (0.99) | CHRM3ADRB2 | |
| SCHEMBL19088747 | 0.91 | CHRM3 (0.79) | CHRM3ADRB2 | |
| SCHEMBL741158 | 0.91 | CHRM3 (1.00) | CHRM3ADRB2 | |
| Oxalic Acid SCHEMBL890700 | 0.90 | CHRM3 (0.97) | CHRM3ADRB2 | |
| Oxalic Acid SCHEMBL890698 | 0.90 | CHRM3 (0.97) | CHRM3ADRB2 | |
| Oxalic Acid SCHEMBL890819 | 0.90 | CHRM3 (0.96) | CHRM3ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017114377-A1 | BENZYL HETEROCYCLIC COMPOUND DERIVATIVE AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2017-07-06 | — | — | WO | disclosed |