Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 9/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CCR5 | P51681 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL10049869 | 0.78 | SMN1; SMN2 (0.48) | KDM4ECYP1A2CYP2D6PDE4ASMN1; SMN2 | |
| SCHEMBL10050013 | 0.75 | PTGER1 (0.48) | KDM4ECYP1A2CYP2D6PDE4ASMN1; SMN2 | |
| SCHEMBL1646591 | 0.74 | LRRK2 (0.61) | LRRK2SMN1; SMN2SMPD1MAOBCCR5 | |
| SCHEMBL2772497 | 0.73 | SMN1; SMN2 (0.49) | AKR1C2AKR1C1KDM4ECYP1A2SMN1; SMN2 | |
| SCHEMBL548028 | 0.72 | LRRK2 (0.53) | LRRK2KDM4ECCR5 | |
| SCHEMBL6492975 | 0.72 | LRRK2 (0.60) | LRRK2KDM4EHDAC6SMPD1CCR5 | |
| SCHEMBL10049810 | 0.71 | CNR2 (0.54) | SMN1; SMN2CCR5 | |
| SCHEMBL13413498 | 0.71 | MAPT (0.60) | CYP1A2SMN1; SMN2HDAC6SMPD1 | |
| SCHEMBL1647292 | 0.71 | LRRK2 (0.58) | LRRK2KDM4ESMPD1MAOBCCR5 | |
| SCHEMBL16307018 | 0.70 | PTGDR2 (0.66) | AKR1C2AKR1C1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2128148-A1 | COMPOUND, ALPHA 1 ADRENALINE RECEPTOR ANTAGONIST, AND COMPOSITION | Suntory Holdings Limited (JP) | 2009-12-02 | — | — | EP | disclosed |