Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 7/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.34 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD5 | P21918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27422134 | 0.82 | HSD11B1 (0.34) | OPRK1SLC6A4 | |
| SCHEMBL4781128 | 0.82 | HSD11B1 (0.34) | OPRK1SLC6A4 | |
| SCHEMBL633353 | 0.82 | SLC6A2 (0.43) | OPRM1OPRD1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL11096567 | 0.78 | OPRM1 (0.46) | OPRK1OPRM1OPRD1 | |
| SCHEMBL4593876 | 0.75 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL7458612 | 0.74 | OPRM1 (0.34) | OPRM1 | |
| SCHEMBL27422130 | 0.74 | OPRM1 (0.34) | OPRM1 | |
| SCHEMBL8812050 | 0.73 | OPRM1 (0.36) | OPRK1OPRM1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL30580699 | 0.73 | HSD11B1 (0.37) | OPRM1SLC6A4CHRNA1CHRNGCHRNB1 | |
| SCHEMBL5971560 | 0.73 | SLC6A4 (0.35) | OPRM1SLC6A4SLC6A2SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1434604-A4 | 4-HALOETHENYLPHENYL TROPANE:SEROTONIN TRANSPORTER IMAGING AGENTS | UNIV EMORY (US) | 2008-01-09 | — | — | EP | disclosed |
| EP-1434604-A2 | 4-HALOETHENYLPHENYL TROPANE:SEROTONIN TRANSPORTER IMAGING AGENTS | Emory University (US) | 2004-07-07 | — | — | EP | disclosed |
| WO-2003031452-A2 | 4-HALOETHENYLPHENYL TROPANE:SEROTONIN TRANSPORTER IMAGING AGENTS | EMORY UNIVERSITY (US) | 2003-04-17 | — | — | WO | disclosed |