Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 8/20 | 0.48 |
| ▸ | HTR2A | P28223 | 8/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2172475 | 0.91 | HRH1 (0.56) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| SCHEMBL30171026 | 0.88 | HRH1 (0.54) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| SCHEMBL107889 | 0.80 | HRH1 (0.56) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| SCHEMBL30312009 | 0.78 | AOC3 (0.42) | SIGMAR1HRH1HTR2ALMNAOPRM1 | |
| SCHEMBL6702276 | 0.78 | CYP19A1 (0.49) | SIGMAR1HRH1HTR2ALMNASLC6A4 | |
| Hydrochloric Acid SCHEMBL6521685 | 0.78 | HRH1 (0.54) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| SCHEMBL28229621 | 0.78 | HRH1 (0.54) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| Ammonia Solution, Strong SCHEMBL5724927 | 0.78 | HRH1 (0.54) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| Hydrogen Peroxide SCHEMBL27864054 | 0.78 | HRH1 (0.54) | SIGMAR1HRH1HTR2ACYP3A4LMNA | |
| Butane SCHEMBL16459462 | 0.77 | SIGMAR1 (0.57) | SIGMAR1HRH1HTR2ACYP3A4LMNA |
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-6054448-A | TREATMENT OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM. | ELI LILLY AND COMPANY LIMITED (GB) | 2000-04-25 | — | — | US | disclosed |
| EP-0837061-A1 | Pharmaceutical acidic compounds | ELI LILLY AND COMPANY LIMITED (GB) | 1998-04-22 | — | — | EP | disclosed |