Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8144169 | 1.00 | CHRM2 (0.33) | CHRM2CHRM1CHRM3CA12CA14 | |
| SCHEMBL16759533 | 0.85 | CHRM2 (0.31) | CHRM2CHRM1CHRM3 | |
| SCHEMBL16759709 | 0.85 | CHRM2 (0.31) | CHRM2CHRM1CHRM3 | |
| SCHEMBL16759581 | 0.85 | CHRM2 (0.31) | CHRM2CHRM1CHRM3 | |
| SCHEMBL8144279 | 0.84 | ARG1 (0.32) | — | |
| SCHEMBL8150637 | 0.81 | BTK (0.41) | — | |
| SCHEMBL8143603 | 0.81 | BTK (0.41) | — | |
| SCHEMBL8141345 | 0.80 | — | — | |
| SCHEMBL27383131 | 0.79 | DGAT1 (0.35) | — | |
| SCHEMBL8143545 | 0.75 | NPSR1 (0.37) | — |
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-2000001714-A1 | EFFLUX PUMP INHIBITORS | MICROCIDE PHARMACEUTICALS, INC. (US) | 2000-01-13 | — | — | WO | disclosed |