Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4948056 | 0.93 | HTR1A (0.43) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4947508 | 0.92 | HTR1A (0.43) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4951013 | 0.89 | HTR1A (0.41) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4945965 | 0.88 | HTR1A (0.41) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4950975 | 0.88 | HTR1A (0.42) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4953234 | 0.88 | HTR1A (0.41) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4950289 | 0.85 | HTR1A (0.52) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4952024 | 0.84 | HTR1A (0.53) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4949840 | 0.84 | HTR1A (0.49) | HTR1AADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL4948124 | 0.83 | HTR1A (0.41) | HTR1AADRA2AADRA2BADRA2CADRA1D |
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 |
|---|---|---|---|---|---|---|---|
| JP-2008526700-A | — | — | 2008-07-24 | — | — | JP | claimed |
| EP-1761524-A1 | PHENYL DIAZEPANE CARBOXAMIDES AND ANNELATED PHENYL PIPERAZINE CARBOXAMIDES CONTAINING OXYGEN AND USED AS DOPAMINE D3 ANTAGONISTS | SCHWARZ PHARMA AG (DE) | 2007-03-14 | — | — | EP | claimed |
| WO-2006072430-A1 | PHENYL DIAZEPANE CARBOXAMIDES AND ANNELATED PHENYL PIPERAZINE CARBOXAMIDES CONTAINING OXYGEN AND USED AS DOPAMINE D3 ANTAGONISTS | SCHWARZ PHARMA AG (DE) | 2006-07-13 | — | — | WO | claimed |