Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | DRD1 | P21728 | 11/20 | 0.57 |
| ▸ | DRD5 | P21918 | 5/20 | 0.55 |
| ▸ | DRD2 | P14416 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.54 |
| ▸ | GPR183 | P32249 | 1/20 | 0.54 |
| ▸ | APLNR | P35414 | 1/20 | 0.54 |
| ▸ | GLP1R | P43220 | 1/20 | 0.54 |
| ▸ | CX3CR1 | P49238 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8769108 | 0.88 | CYP2D6 (0.63) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL11939886 | 0.88 | CYP2D6 (0.81) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL11112777 | 0.88 | CYP2D6 (0.81) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL8768800 | 0.88 | CYP2D6 (0.63) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL13901050 | 0.84 | CYP2D6 (0.61) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL10692719 | 0.84 | CYP2D6 (0.58) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL8769365 | 0.83 | DRD1 (0.80) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| Bromide SCHEMBL10693115 | 0.83 | CYP2D6 (0.57) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL10694750 | 0.83 | CYP2D6 (0.63) | CYP2D6CYP3A4DRD1DRD5DRD2 | |
| SCHEMBL10691596 | 0.83 | CYP2D6 (0.59) | CYP2D6CYP3A4DRD1DRD5DRD2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0391554-B1 | Dopamine receptor ligands and imaging agents | UNIV PENNSYLVANIA (US) | 1997-09-10 | — | — | EP | claimed |
| US-5068326-A | Agents for imaging human brains, 8-chloro-2,3,4,5-tetrahydro-3 -methyl-5-(4'-(125I)iodophenyl)-1H-3-benzazepine | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 1991-11-26 | — | — | US | claimed |
| EP-0391554-A1 | Dopamine receptor ligands and imaging agents | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1990-10-10 | — | — | EP | claimed |
| EP-0391554-B1 | Dopamine receptor ligands and imaging agents | UNIV PENNSYLVANIA (US) | 1997-09-10 | — | — | EP | disclosed |
| US-5130117-A | Imaging agents; monitor effectiveness of drugs in nervous and mental disorders | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1992-07-14 | — | — | US | disclosed |
| EP-0391554-A1 | Dopamine receptor ligands and imaging agents | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1990-10-10 | — | — | EP | disclosed |