Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 4/20 | 0.45 |
| ▸ | HRH2 | P25021 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | HTR2B | P41595 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TEK | Q02763 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6482143 | 0.92 | HRH1 (0.54) | HRH1HRH2HTR2ADRD3HTR2B | |
| SCHEMBL10931334 | 0.92 | TDP1 (0.39) | HRH1HRH2HTR2ADRD3HTR2B | |
| Hydrochloric Acid SCHEMBL5957369 | 0.91 | HRH1 (0.55) | HRH1HRH2HTR2ADRD3HTR2B | |
| SCHEMBL5683230 | 0.81 | TDP1 (0.41) | HRH1HRH2HTR2ADRD3HTR2B | |
| SCHEMBL16757280 | 0.81 | TDP1 (0.46) | DRD3KCNH2USP2SLC6A2SLC6A4 | |
| SCHEMBL9844393 | 0.80 | OPRD1 (0.42) | SLC6A4TDP1OPRD1 | |
| Hydrochloric Acid SCHEMBL27546451 | 0.77 | HRH1 (0.38) | HRH1HRH2HTR2ADRD3HTR2B | |
| SCHEMBL16757387 | 0.76 | TDP1 (0.42) | DRD3KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3847012 | 0.72 | HRH1 (0.83) | HRH1HRH2HTR2ADRD3HTR2B | |
| SCHEMBL1376101 | 0.72 | HRH1 (0.83) | HRH1HRH2HTR2ADRD3HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-6908999-B2 | Hydrolysis of N,N-disubstituted (2-(4-(alpha-phenyl-p-chloro-benzyl)piperazin-1-yl)ethoxy)acetamide, to form cetirizine and salts, used as antiallergens | EGIS GYOGYSZERGYAR RT. (HU) | 2005-06-21 | — | — | US | disclosed |