Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 19/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 17/20 | 0.72 |
| ▸ | KCNH2 | Q12809 | 11/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 8/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.64 |
| ▸ | HTR2B | P41595 | 1/20 | 0.64 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.64 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12930701 | 0.88 | HRH1 (0.71) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL18388464 | 0.88 | HRH1 (0.78) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL12930742 | 0.88 | HRH1 (0.70) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL20697482 | 0.88 | HRH1 (0.70) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL12930707 | 0.88 | HRH1 (0.70) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL12930734 | 0.88 | HRH1 (0.70) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL12930718 | 0.88 | HRH1 (0.70) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL5225966 | 0.87 | HRH1 (0.77) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL12930743 | 0.87 | HRH1 (0.69) | HRH1CYP2D6KCNH2CHRM1ADRA2A | |
| SCHEMBL18388400 | 0.87 | HRH1 (0.69) | HRH1CYP2D6KCNH2CHRM1ADRA2A |
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-2010151711-A1 | PRODRUGS OF NH-ACIDIC COMPOUNDS | ALKERMES, INC. (US) | 2010-12-29 | — | — | WO | disclosed |