Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD5 | P21918 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL8535132 | 0.80 | OPRM1 (0.44) | SLC6A4SLC6A3OPRM1OPRD1SLC6A2 | |
| SCHEMBL10295475 | 0.80 | OPRM1 (0.64) | DRD2DRD3OPRM1OPRD1 | |
| SCHEMBL12314083 | 0.80 | OPRM1 (0.64) | DRD2DRD3OPRM1OPRD1 | |
| SCHEMBL4781131 | 0.79 | SLC18A3 (0.49) | SLC18A3SIGMAR1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL633352 | 0.78 | SLC6A2 (0.55) | SLC18A3SIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL1721954 | 0.78 | SLC6A2 (0.55) | SLC18A3SIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL633351 | 0.78 | SLC6A2 (0.55) | SLC18A3SIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL22849885 | 0.77 | KDM1A (0.53) | SLC18A3SIGMAR1DRD2DRD1DRD4 | |
| SCHEMBL10295474 | 0.76 | DRD3 (0.58) | DRD2DRD3 | |
| SCHEMBL12314095 | 0.76 | DRD3 (0.58) | DRD2DRD3 |
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 |