Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 8/20 | 0.56 |
| ▸ | ADRA1D | P25100 | 7/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 7/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7301761 | 0.84 | ADRA1A (0.60) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL3954997 | 0.83 | ADRA1D (0.58) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL3955000 | 0.83 | ADRA1D (0.58) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL14621895 | 0.81 | DRD2 (0.67) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL217093 | 0.81 | DRD2 (0.66) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL30159754 | 0.80 | HTR6 (0.68) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL3867980 | 0.80 | HTR6 (0.68) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL3951002 | 0.80 | HTR6 (0.68) | ADRA1AADRA1DADRA1BHTR1A | |
| Hydrochloric Acid SCHEMBL4519236 | 0.79 | LMNA (0.69) | ADRA1AADRA1DADRA1BHTR1A | |
| SCHEMBL7690863 | 0.78 | ADRA1A (0.57) | ADRA1AADRA1DADRA1BHTR1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006092710-A1 | METABOLITES OF 2-{3-[4-(2-ISOPROPOXYPHENYL) PIPERAZIN-1-YL]-PROPYL}-3A,4,7,7A-TETRAHYDRO-1H-ISOINDOLE-1,3-(2H)-DIONE | RANBAXY LABORATORIES LIMITED (IN) | 2006-09-08 | — | — | WO | disclosed |