Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 4/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9412241 | 0.94 | HRH3 (0.43) | CHRM1HTR2AMCHR1CHRM2SLC6A2 | |
| SCHEMBL9004099 | 0.94 | HRH3 (0.43) | CHRM1HTR2AMCHR1CHRM2SLC6A2 | |
| SCHEMBL9004074 | 0.93 | HRH3 (0.41) | CHRM2SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL9004134 | 0.88 | CHRM1 (0.41) | CHRM1HTR2AMCHR1CHRM2HTR1A | |
| SCHEMBL9004137 | 0.85 | POLB (0.44) | CYP1A2CYP2D6TSHRCYP2C19HTT | |
| SCHEMBL9004097 | 0.84 | LTA4H (0.41) | CHRM1HTR2AMCHR1HRH3LTA4H | |
| SCHEMBL9004170 | 0.84 | KEAP1 (0.43) | HRH3 | |
| SCHEMBL9004061 | 0.84 | HRH3 (0.43) | SLC6A4HRH3ACHEMAOBHTT | |
| SCHEMBL9004145 | 0.82 | CYP3A4 (0.42) | CHRM1HTR2ACYP3A4CHRM2HTR1A | |
| SCHEMBL9004060 | 0.81 | HRH3 (0.44) | CHRM1HTR2AMCHR1CHRM2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5486528-A | ANTIULCER AGENTS, ANXIOLYTIC AGENTS | EGIS GYOGYSZERGYAR RT. (HU) | 1996-01-23 | — | — | US | disclosed |
| EP-0619299-A2 | 1-(Phenyl)-3-[omega-(amino)-alkoxyimino]-alk-1-ene derivatives, a process for preparing them as well as medicaments containing them and the use of them | EGIS GYOGYSZERGYAR RT. (HU) | 1994-10-12 | — | — | EP | disclosed |