Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.53 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.53 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27544020 | 0.80 | ADRB1 (0.47) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL7258863 | 0.78 | ADRB1 (0.44) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL7230204 | 0.78 | ADRB1 (0.44) | ADRB1SIRT6KCNJ1KCNH2ALDH1A1 | |
| SCHEMBL28408131 | 0.77 | ADRB1 (0.43) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL522461 | 0.77 | ADRB1 (0.43) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL27758968 | 0.76 | ADRB1 (0.43) | ADRB1SIRT6KCNJ1KCNH2ALDH1A1 | |
| SCHEMBL8127951 | 0.74 | ADRB1 (0.45) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL8133139 | 0.74 | ADRB1 (0.45) | ADRB1SIRT6KCNJ1KCNH2HTR7 | |
| SCHEMBL30165832 | 0.72 | ALDH1A1 (0.50) | ADRB1SIRT6ALDH1A1MAPTKDM4E | |
| SCHEMBL9786136 | 0.72 | LMNA (0.43) | ADRB1SIRT6KCNJ1KCNH2ALDH1A1 |
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-6022966-A | CONJUGATE COMPRISES A DOTA CHELATE COMPONENT, A BIOTIN COMPONENT AND A LINKER COMPONENT RESISTANT TO BIOTINIDASE CLEAVAGE | NEORX CORPORATION (US) | 2000-02-08 | — | — | US | disclosed |