Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.54 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11865232 | 0.99 | SIGMAR1 (0.53) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11868978 | 0.89 | SIGMAR1 (0.54) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11863524 | 0.84 | SIGMAR1 (0.58) | SIGMAR1HRH3 | |
| SCHEMBL11680152 | 0.84 | SIGMAR1 (0.58) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| Hydrochloric Acid SCHEMBL11678798 | 0.83 | SIGMAR1 (0.56) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11782472 | 0.82 | HRH1 (0.58) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11751988 | 0.81 | SIGMAR1 (0.54) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11750620 | 0.80 | HRH3 (0.49) | SIGMAR1HRH3DRD2 | |
| SCHEMBL11748272 | 0.80 | SIGMAR1 (0.52) | SIGMAR1HRH1HRH3DRD2SLC6A4 | |
| SCHEMBL11750577 | 0.76 | HTR2A (0.36) | DRD2SLC6A4 |
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 4 patents. 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 |
| US-4041165-A | TREATING DELAYED HYPERSENSITIVITY | RICHARDSON-MERRELL INC. (US) | 1977-08-09 | — | — | US | disclosed |
| US-3957988-A | Antiviral compositions containing bis-basic ketones of thioxanthene | RICHARDSON-MERRELL INC. (US) | 1976-05-18 | — | — | US | disclosed |
| US-3937833-A | DELAYED HYPERSENSITIVITY | RICHARDSON-MERRELL INC. (US) | 1976-02-10 | — | — | US | disclosed |