Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11244654 | 0.93 | SIGMAR1 (0.54) | CHRNA7ALDH1A1LMNAMAPTHTT | |
| SCHEMBL11338350 | 0.89 | CHRNA7 (0.50) | CHRNA7DRD2NR1I2ADRB1HTR1A | |
| SCHEMBL11326948 | 0.89 | CHRNA7 (0.50) | CHRNA7DRD2NR1I2ADRB1HTR1A | |
| SCHEMBL11784439 | 0.88 | CHRNA7 (0.56) | CHRNA7DRD2HTR2AHTR2CKCNH2 | |
| SCHEMBL11620008 | 0.86 | TLR9 (0.48) | CHRNA7ALDH1A1HTTDRD2HTR2A | |
| SCHEMBL11783437 | 0.84 | DRD2 (0.70) | CHRNA7DRD2NR1I2ADRB1HTR1A | |
| Hydrochloric Acid SCHEMBL11335313 | 0.83 | DRD2 (0.69) | CHRNA7ALDH1A1HTTDRD2NR1I2 | |
| SCHEMBL11230661 | 0.83 | SIGMAR1 (0.52) | ADRA2AADRA2BADRA2CHTR2BKMT2A | |
| SCHEMBL11228025 | 0.81 | SIGMAR1 (0.59) | CHRNA7KMT2ASIGMAR1 | |
| SCHEMBL11226070 | 0.81 | HTR1D (0.51) | ALDH1A1MAPTHTR1ASLC6A2KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE28973-E | PARKINSON'S DISEASE | A. H. ROBINS COMPANY, INCORPORATED (US) | 1976-09-21 | — | — | US | claimed |
| US-RE28973-E | PARKINSON'S DISEASE | A. H. ROBINS COMPANY, INCORPORATED (US) | 1976-09-21 | — | — | US | disclosed |