Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 9/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 9/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 9/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5240516 | 0.99 | CCR1 (0.43) | CCR1EPHX2CHRM2CHRM1CHRM3 | |
| SCHEMBL3981459 | 0.82 | CHRM3 (0.49) | CHRM2CHRM1CHRM3TSHR | |
| SCHEMBL2763733 | 0.73 | CHRM3 (0.41) | CCR1CHRM2CHRM1CHRM3CYP2D6 | |
| SCHEMBL5999930 | 0.71 | EPHX2 (0.45) | CCR1EPHX2CHRM2CHRM1CHRM3 | |
| SCHEMBL2796932 | 0.69 | CHRM3 (0.40) | CCR1CHRM2CHRM1CHRM3CYP2D6 | |
| SCHEMBL4618235 | 0.68 | KEAP1 (0.53) | CCR1EPHX2CHRM2CHRM1CHRM3 | |
| SCHEMBL13116345 | 0.68 | KEAP1 (0.53) | CCR1EPHX2CHRM2CHRM1CHRM3 | |
| SCHEMBL7569557 | 0.68 | KEAP1 (0.53) | CHRM2CHRM1CHRM3CYP2D6KCNH2 | |
| Hydrochloric Acid SCHEMBL7433430 | 0.68 | CHRM2 (0.43) | CHRM2CHRM1CHRM3CYP2D6KCNH2 | |
| SCHEMBL4887507 | 0.67 | HTT (0.60) | CHRM2CHRM1CHRM3CYP2D6KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1794161-A2 | MUSCARINIC RECEPTOR ANTAGONISTS | Ranbaxy Laboratories Limited (IN) | 2007-06-13 | — | — | EP | disclosed |
| WO-2006032994-A2 | MUSCARINIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2006-03-30 | — | — | WO | disclosed |