Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.35 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.35 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6610561 | 0.77 | AR (0.39) | CHRNA7MAP3K7TAB1CNR2 | |
| Bromide SCHEMBL6140069 | 0.76 | AR (0.39) | CHRNA7MAP3K7TAB1CNR2 | |
| SCHEMBL1689211 | 0.73 | CHRNA7 (0.63) | CHRNA7ALDH1A1 | |
| SCHEMBL5115363 | 0.70 | CYP11B1 (0.41) | CHRNA7HTR2AHTR2CHTR2BALDH1A1 | |
| SCHEMBL5116073 | 0.70 | CYP11B1 (0.43) | HTR2AHTR2CHTR2BALDH1A1 | |
| Hydrochloric Acid SCHEMBL5123727 | 0.69 | CYP11B1 (0.42) | HTR2AHTR2CHTR2BALDH1A1 | |
| SCHEMBL3326208 | 0.68 | CHRNA7 (0.72) | CHRNA7ALDH1A1 | |
| SCHEMBL5108182 | 0.68 | HDAC8 (0.41) | CNR1ALDH1A1CNR2 | |
| Hydrochloric Acid SCHEMBL3525790 | 0.68 | CHRNA7 (0.71) | CHRNA7ALDH1A1 | |
| SCHEMBL5110600 | 0.67 | HDAC8 (0.42) | CHRNA7CNR1CNR2 |
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-1599476-A1 | NOVEL DIAZABICYCLIC ARYL DERIVATIVES | NEUROSEARCH A/S (DK) | 2005-11-30 | — | — | EP | claimed |
| WO-2004076453-A1 | NOVEL DIAZABICYCLIC ARYL DERIVATIVES | NEUROSEARCH A/S (DK) | 2004-09-10 | — | — | WO | claimed |