Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 10/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27730035 | 0.80 | KEAP1 (0.47) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL18196842 | 0.79 | ALDH1A1 (0.65) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL18196840 | 0.78 | POLB (0.65) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL20253541 | 0.77 | ALDH1A1 (0.62) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL25134509 | 0.76 | KEAP1 (0.60) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL3053693 | 0.76 | ALDH1A1 (0.47) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL3042271 | 0.75 | POLB (0.47) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| SCHEMBL5134240 | 0.75 | ALDH1A1 (0.47) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| Iodide SCHEMBL3038907 | 0.74 | ALDH1A1 (0.46) | ALDH1A1POLBKEAP1NFE2L2CHRM3 | |
| Iodide SCHEMBL3049800 | 0.73 | ALDH1A1 (0.45) | ALDH1A1POLBKEAP1NFE2L2CHRM3 |
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-1968945-A2 | MUSCARINIC RECEPTOR ANTAGONISTS | Ranbaxy Laboratories Limited (IN) | 2008-09-17 | — | — | EP | claimed |
| WO-2007077510-A2 | MUSCARINIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-07-12 | — | — | WO | claimed |