Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 13/20 | 0.72 |
| ▸ | DRD3 | P35462 | 12/20 | 0.69 |
| ▸ | FAAH | O00519 | 4/20 | 0.69 |
| ▸ | DRD4 | P21917 | 6/20 | 0.66 |
| ▸ | CNR1 | P21554 | 1/20 | 0.66 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.66 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.65 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.65 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.65 |
| ▸ | HTR1A | P08908 | 1/20 | 0.65 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.65 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.65 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.65 |
| ▸ | DRD1 | P21728 | 1/20 | 0.65 |
| ▸ | DRD5 | P21918 | 1/20 | 0.65 |
| ▸ | HTR2A | P28223 | 1/20 | 0.65 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.65 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.65 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8828671 | 0.99 | DRD2 (0.71) | DRD2DRD3FAAHDRD4CNR1 | |
| SCHEMBL3162960 | 0.86 | DRD2 (0.76) | DRD2DRD3FAAHDRD4SLC6A2 | |
| SCHEMBL1388189 | 0.84 | DRD2 (0.72) | DRD2DRD3DRD4SLC6A2SLC6A4 | |
| SCHEMBL16406399 | 0.84 | DRD3 (0.82) | DRD2DRD3FAAHCNR1 | |
| SCHEMBL27966706 | 0.84 | DRD2 (1.00) | DRD2DRD3FAAHDRD4CNR1 | |
| SCHEMBL7869518 | 0.84 | DRD2 (1.00) | DRD2DRD3FAAHDRD4CNR1 | |
| Hydrochloric Acid SCHEMBL17889748 | 0.83 | DRD3 (0.82) | DRD2DRD3FAAHCNR1 | |
| Hydrochloric Acid SCHEMBL8980926 | 0.83 | DRD2 (0.70) | DRD2DRD3DRD4SLC6A2SLC6A4 | |
| SCHEMBL28649504 | 0.83 | KEAP1 (0.61) | DRD2 | |
| SCHEMBL14761584 | 0.83 | DRD2 (0.94) | DRD2DRD3DRD4SLC6A2SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5688795-A | URINARY TRACTS OBSTRUCTION | SYNTEX (U.S.A.) INC. (US) | 1997-11-18 | — | — | US | disclosed |
| EP-0711757-A1 | 3-(4-phenylpiperazin-1-yl)propyl-amino, thio and oxy -pyridine, pyrimidine and benzene derivatives as alpha1-adrenoceptor antagonists | F. Hoffmann-La Roche AG (CH) | 1996-05-15 | — | — | EP | disclosed |