Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.56 |
| ▸ | HTR2C | P28335 | 2/20 | 0.56 |
| ▸ | HTR2B | P41595 | 2/20 | 0.56 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.56 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.56 |
| ▸ | HRH1 | P35367 | 1/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.56 |
| ▸ | HTR5A | P47898 | 1/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | POLA1 | P09884 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL18408182 | 0.87 | HTR2C (0.50) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL15728018 | 0.84 | SIGMAR1 (0.53) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL2817474 | 0.83 | HTR2C (0.55) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL18408494 | 0.78 | ALDH1A1 (0.39) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL18408495 | 0.77 | ESR1 (0.45) | SIGMAR1SLC6A2OPRM1OPRK1SLC6A3 | |
| Hydrochloric Acid SCHEMBL7943780 | 0.76 | SIGMAR1 (0.61) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL2819328 | 0.76 | HTR2C (0.48) | ADRA2ASIGMAR1HTR2CHTR2BADRB2 | |
| SCHEMBL18407965 | 0.74 | MAOA (0.41) | HTR2CHTR2BHTR2A | |
| SCHEMBL6937686 | 0.73 | HTR2A (0.54) | SIGMAR1HTR2CHTR2BHTR2ACYP19A1 | |
| SCHEMBL18407945 | 0.73 | MAOA (0.43) | ALDH1A1MTNR1A |
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-2014075874-A1 | MICROBIOCIDAL PYRAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2014-05-22 | — | — | WO | disclosed |