Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.44 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11859118 | 0.99 | KCNH2 (0.43) | KCNH2BIRC5SLC6A2SLC6A4CHRM2 | |
| SCHEMBL11867678 | 0.90 | KCNH2 (0.40) | KCNH2SLC6A2SLC6A4DRD1ADRA1A | |
| SCHEMBL11862034 | 0.85 | SIGMAR1 (0.47) | KCNH2SLC6A2SLC6A4CHRM2HTR1A | |
| Hydrochloric Acid SCHEMBL11862820 | 0.84 | SIGMAR1 (0.46) | KCNH2SLC6A2SLC6A4HTR1ADRD2 | |
| SCHEMBL11678306 | 0.84 | KCNH2 (0.48) | KCNH2BIRC5SLC6A2SLC6A4CHRM2 | |
| Hydrochloric Acid SCHEMBL11780293 | 0.82 | KCNH2 (0.47) | KCNH2BIRC5SLC6A2SLC6A4CHRM2 | |
| SCHEMBL11816574 | 0.82 | OPRM1 (0.36) | KCNH2SLC6A2SLC6A4OPRM1BCHE | |
| SCHEMBL11832433 | 0.80 | KCNH2 (0.44) | KCNH2BIRC5SLC6A2SLC6A4CHRM2 | |
| SCHEMBL11750577 | 0.77 | HTR2A (0.36) | SLC6A2SLC6A4DRD2HTR2AHTR2C | |
| SCHEMBL9670241 | 0.76 | KCNH2 (0.68) | KCNH2BIRC5SLC6A2SLC6A4CHRM2 |
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-3957988-A | Antiviral compositions containing bis-basic ketones of thioxanthene | RICHARDSON-MERRELL INC. (US) | 1976-05-18 | — | — | US | claimed |