Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5332634 | 0.89 | HTR2A (0.41) | HTR2AKCNH2CYP19A1SIGMAR1CHRM2 | |
| SCHEMBL27464580 | 0.87 | HTR2A (0.55) | HTR2AKCNH2CYP19A1SIGMAR1CHRM2 | |
| SCHEMBL10437920 | 0.84 | CYP19A1 (0.43) | HTR2ACYP19A1POLB | |
| SCHEMBL27464581 | 0.84 | HTR2A (0.59) | HTR2AKCNH2CYP19A1SIGMAR1CHRM2 | |
| SCHEMBL11712943 | 0.83 | CYP19A1 (0.39) | HTR2AKCNH2CYP19A1SIGMAR1SLC6A2 | |
| SCHEMBL6570932 | 0.83 | CYP19A1 (0.46) | KCNH2CYP19A1SIGMAR1 | |
| SCHEMBL28056319 | 0.80 | CYP19A1 (0.49) | HTR2AKCNH2CYP19A1SIGMAR1CHRM2 | |
| SCHEMBL815294 | 0.80 | ESR1 (0.40) | HTR2ACHRM2ADRA2ACHRM1SLC6A2 | |
| SCHEMBL10358926 | 0.80 | NR1I2 (0.42) | OPRM1 | |
| SCHEMBL6682155 | 0.80 | SIGMAR1 (0.46) | HTR2ASIGMAR1OPRM1POLBCYSLTR2 |
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-2005037797-A1 | SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-04-28 | — | — | WO | claimed |