Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ATP4A | P20648 | 3/20 | 0.40 |
| ▸ | ATP4B | P51164 | 3/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.40 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.40 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.40 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.40 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8323388 | 0.90 | ADRA2A (0.45) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| SCHEMBL7964742 | 0.88 | CYP1A2 (0.44) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| SCHEMBL8321782 | 0.86 | CYP1A2 (0.42) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| SCHEMBL795384 | 0.83 | ATP4A (0.62) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL5108689 | 0.79 | KDM4E (0.51) | ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL900644 | 0.76 | ADRA2A (0.53) | ADRA2AADRA2BADRA2CADRA1ACYP3A4 | |
| SCHEMBL8051208 | 0.76 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| SCHEMBL7149054 | 0.76 | ADRA2A (0.56) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| SCHEMBL801036 | 0.76 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CADRA1ACYP1A2 | |
| Hydrochloric Acid SCHEMBL900773 | 0.75 | ADRA2A (0.52) | ADRA2AADRA2BADRA2CADRA1ACYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0730594-B1 | 9-HYDROXY-PYRIDO [1,2-a]PYRIMIDIN-4-ONE ETHER DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 1999-09-08 | — | — | EP | disclosed |
| US-5688799-A | NEUROTRANSMITTER ANTAGONIST | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-11-18 | — | — | US | disclosed |
| EP-0730594-A1 | NOVEL 9-HYDROXY-PYRIDO [1,2-a]PYRIMIDIN-4-ONE ETHER DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014691-A1 | NOVEL 9-HYDROXY-PYRIDO[1,2-a]PYRIMIDIN-4-ONE ETHER DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1995-06-01 | — | — | WO | disclosed |