Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 13/20 | 0.64 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.59 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.59 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.59 |
| ▸ | DRD1 | P21728 | 1/20 | 0.59 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | CASR | P41180 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL15130899 | 1.00 | SIGMAR1 (0.64) | SIGMAR1EPHX2CYP3A4KCNH2CHRM2 | |
| Hydrochloric Acid SCHEMBL15572364 | 0.98 | SIGMAR1 (0.62) | SIGMAR1EPHX2CYP3A4KCNH2CHRM2 | |
| SCHEMBL15131171 | 0.95 | SIGMAR1 (0.65) | SIGMAR1EPHX2CYP3A4KCNH2CHRM2 | |
| SCHEMBL12269593 | 0.89 | CYP3A4 (0.63) | SIGMAR1EPHX2CYP3A4KCNH2CHRM2 | |
| SCHEMBL27576246 | 0.89 | CYP3A4 (0.63) | SIGMAR1EPHX2CYP3A4KCNH2CHRM2 | |
| SCHEMBL15131051 | 0.89 | SIGMAR1 (0.55) | SIGMAR1EPHX2HTR1AALDH1A1SMN1; SMN2 | |
| SCHEMBL5461331 | 0.86 | CYP3A4 (0.70) | SIGMAR1CYP3A4KCNH2CHRM2HTR1A | |
| SCHEMBL10779809 | 0.86 | CYP3A4 (0.70) | SIGMAR1CYP3A4KCNH2CHRM2HTR1A | |
| SCHEMBL1101513 | 0.86 | CYP3A4 (0.70) | SIGMAR1CYP3A4KCNH2CHRM2HTR1A | |
| SCHEMBL15131102 | 0.86 | SIGMAR1 (0.53) | SIGMAR1EPHX2CYP3A4CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1281702-A2 | Calcium receptor active molecules | NPS PHARMACEUTICALS, INC. (US) | 2003-02-05 | — | — | EP | claimed |