Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | HRH1 | P35367 | 3/20 | 0.47 |
| ▸ | DRD3 | P35462 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.47 |
| ▸ | GMNN | O75496 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7437637 | 0.88 | MEN1 (0.40) | PAX8KCNH2HRH1DRD3HTR2A | |
| SCHEMBL7432529 | 0.88 | PAX8 (0.52) | PAX8KCNH2LMNAHRH1DRD3 | |
| Oxalic Acid SCHEMBL7438851 | 0.87 | PAX8 (0.51) | PAX8KCNH2LMNAHRH1DRD3 | |
| Water SCHEMBL7428725 | 0.87 | PAX8 (0.51) | PAX8KCNH2LMNAHRH1DRD3 | |
| SCHEMBL10461269 | 0.85 | PAX8 (0.51) | PAX8KCNH2HRH1DRD3HTR2A | |
| SCHEMBL10557081 | 0.84 | PAX8 (0.60) | PAX8KCNH2HRH1MEN1HTR1A | |
| SCHEMBL10461659 | 0.83 | PAX8 (0.50) | PAX8KCNH2HRH1HTR2ADRD2 | |
| SCHEMBL7436604 | 0.82 | PAX8 (0.47) | PAX8KCNH2LMNAHRH1DRD3 | |
| SCHEMBL7446585 | 0.82 | PAX8 (0.53) | PAX8KCNH2HRH1DRD3HTR2A | |
| SCHEMBL30627531 | 0.82 | ABCB11 (0.62) | PAX8KCNH2HRH1DRD3HTR2A |
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-5070087-A | Aryl(alkyland alkylene)-N-((phenoxy and phenylthio)alkyl) aminoheterocyclics as cardiovascular, anthihistaminic, antisecretory and antiallergy agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-12-03 | — | — | US | disclosed |