Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 20/20 | 0.81 |
| ▸ | CHRM3 | P20309 | 20/20 | 0.81 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.81 |
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 | |
|---|---|---|---|---|
| SCHEMBL19088764 | 1.00 | ADRB2 (0.81) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088742 | 0.93 | ADRB2 (0.81) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088739 | 0.93 | ADRB2 (0.81) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088760 | 0.92 | ADRB2 (0.80) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088740 | 0.92 | ADRB2 (0.87) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088769 | 0.91 | ADRB2 (0.86) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088748 | 0.90 | ADRB2 (0.88) | ADRB2CHRM3CHRM2 | |
| SCHEMBL19088746 | 0.90 | ADRB2 (0.88) | ADRB2CHRM3CHRM2 | |
| Batefenterol SCHEMBL384465 | 0.90 | ADRB2 (1.00) | ADRB2CHRM3CHRM2 | |
| Batefenterol SCHEMBL385358 | 0.90 | ADRB2 (1.00) | ADRB2CHRM3CHRM2 |
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 |