Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11051380 | 0.84 | ESR1 (0.42) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL11047824 | 0.83 | — | — | |
| SCHEMBL10552827 | 0.80 | ESR1 (0.38) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL2105209 | 0.79 | ADRA2A (0.38) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL11047860 | 0.79 | ESR1 (0.37) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL6210930 | 0.76 | ADRA2A (0.36) | ADRA2AADRA2BADRA2CCYP2D6CYP2C19 | |
| SCHEMBL23109096 | 0.76 | ESR1 (0.50) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL8027681 | 0.75 | CYP19A1 (0.37) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| Hydrochloric Acid SCHEMBL6218208 | 0.75 | ADRA2A (0.37) | ADRA2AADRA2BADRA2CCYP2D6CYP2C19 | |
| SCHEMBL13089136 | 0.73 | MAPT (0.42) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4443466-A | DIURETICS, SEDATIVES, ANALGESICS | Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) | 1984-04-17 | — | — | US | claimed |
| EP-0024829-B1 | 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | Farmos-Yhtyma Oy (FI) | 1984-04-25 | — | — | EP | disclosed |
| US-4443466-A | DIURETICS, SEDATIVES, ANALGESICS | Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) | 1984-04-17 | — | — | US | disclosed |