Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | IGF2BP1 | Q9NZI8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5086741 | 0.95 | ADRA1D (0.47) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4948057 | 0.92 | HTR1A (0.49) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4949840 | 0.89 | HTR1A (0.49) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4950289 | 0.89 | HTR1A (0.52) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4945095 | 0.89 | HTR1A (0.48) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4950861 | 0.86 | HTR1A (0.47) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4950504 | 0.86 | HTR1A (0.51) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4950602 | 0.85 | ADRA2A (0.53) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL5095709 | 0.83 | HTR1A (0.43) | HTR1AADRA1DADRA1AADRA2AADRA2C | |
| SCHEMBL4948056 | 0.82 | HTR1A (0.43) | HTR1AADRA1DADRA1AADRA2AADRA2C |
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 |