Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 7/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | MLNR | O43193 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4779791 | 0.83 | CHRM2 (0.40) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| SCHEMBL1109814 | 0.81 | CHRM2 (0.40) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| Bromide SCHEMBL1110634 | 0.81 | LMNA (0.41) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| SCHEMBL4726703 | 0.81 | CHRM2 (0.40) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| SCHEMBL1109894 | 0.81 | CHRM3 (0.42) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| SCHEMBL4726150 | 0.80 | CHRM2 (0.39) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| SCHEMBL4728205 | 0.80 | CHRM3 (0.39) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| Bromide SCHEMBL4726181 | 0.79 | ALDH1A1 (0.40) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| Bromide SCHEMBL4779697 | 0.79 | SMN1; SMN2 (0.40) | CHRM3CHRM2CHRM1ADRA2AADRA2B | |
| Formic Acid SCHEMBL1110591 | 0.78 | CHRM2 (0.39) | CHRM3CHRM2CHRM1ADRA2AADRA2B |
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-2008023157-A1 | NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS M3-RECEPTOR MODULATORS | ARGENTA DISCOVERY LIMITED (GB) | 2008-02-28 | — | — | WO | disclosed |