Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 12/20 | 0.60 |
| ▸ | DRD2 | P14416 | 5/20 | 0.52 |
| ▸ | HTR1A | P08908 | 5/20 | 0.52 |
| ▸ | HTR7 | P34969 | 4/20 | 0.52 |
| ▸ | DRD4 | P21917 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7776890 | 0.90 | DRD2 (0.64) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| SCHEMBL7773395 | 0.88 | SIGMAR1 (0.46) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| Fumaric Acid SCHEMBL7775435 | 0.82 | DRD2 (0.58) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| Fumaric Acid SCHEMBL7776844 | 0.80 | HTR1A (0.42) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| SCHEMBL7773492 | 0.77 | DRD2 (0.45) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| SCHEMBL7520750 | 0.77 | DRD2 (0.54) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| SCHEMBL7773411 | 0.76 | DRD2 (0.57) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| SCHEMBL7856229 | 0.76 | NPC1 (0.42) | SIGMAR1DRD2KDM4ECYP1A2GAA | |
| SCHEMBL7520064 | 0.75 | DRD2 (0.50) | SIGMAR1DRD2HTR1AHTR7DRD4 | |
| Hydrochloric Acid SCHEMBL9766032 | 0.74 | SIGMAR1 (0.98) | SIGMAR1DRD2HTR1AKDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1117663-A2 | 2-PIPERAZINO ALKYLAMINO BENZOAZOLE DERIVATIVES: DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS | NEUROGEN CORPORATION (US) | 2001-07-25 | — | — | EP | claimed |
| WO-2000018767-A2 | 2-PIPERAZINO ALKYLAMINO BENZOAZOLE DERIVATIVES: DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS | NEUROGEN CORPORATION (US) | 2000-04-06 | — | — | WO | claimed |