Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GUCY1B2 | O75343 | 3/20 | 0.36 |
| ▸ | GUCY1A2 | P33402 | 3/20 | 0.36 |
| ▸ | GUCY1A1 | Q02108 | 3/20 | 0.36 |
| ▸ | GUCY1B1 | Q02153 | 3/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7964742 | 0.78 | CYP1A2 (0.44) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL8321782 | 0.77 | CYP1A2 (0.42) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL8322317 | 0.76 | ADRA2A (0.44) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL795384 | 0.75 | ATP4A (0.62) | HTR1ADRD2HTR2ACYP1A2CYP3A4 | |
| SCHEMBL5108689 | 0.71 | KDM4E (0.51) | ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL28430176 | 0.70 | ENPP2 (0.43) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL900644 | 0.69 | ADRA2A (0.53) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL15095108 | 0.69 | ATP4A (0.62) | HTR1ADRD2HTR2ACYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL900773 | 0.68 | ADRA2A (0.52) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL8323388 | 0.67 | ADRA2A (0.45) | ADRA2AADRA2BADRA2CADRA1AHTR1A |
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-2009045489-A2 | PROCESS FOR THE SYNTHESIS OF CMHTP, A PALIPERIDONE INTERMEDIATE | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2009-04-09 | — | — | WO | disclosed |