Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | THRA | P10827 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
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 SCHEMBL11862820 | 0.98 | SIGMAR1 (0.46) | SIGMAR1KCNH2THRATHRBALDH1A1 | |
| SCHEMBL11866467 | 0.85 | KCNH2 (0.44) | SIGMAR1KCNH2HTR2ADRD2SLC6A2 | |
| Hydrochloric Acid SCHEMBL11859118 | 0.84 | KCNH2 (0.43) | SIGMAR1KCNH2HTR2ADRD2SLC6A2 | |
| SCHEMBL11867678 | 0.84 | KCNH2 (0.40) | SIGMAR1KCNH2THRATHRBTSHR | |
| SCHEMBL28167332 | 0.83 | ALDH1A1 (0.54) | SIGMAR1KCNH2THRATHRBALDH1A1 | |
| SCHEMBL11678413 | 0.83 | ALDH1A1 (0.54) | SIGMAR1KCNH2THRATHRBALDH1A1 | |
| SCHEMBL11786146 | 0.81 | ALDH1A1 (0.55) | SIGMAR1KCNH2THRATHRBALDH1A1 | |
| SCHEMBL11750577 | 0.80 | HTR2A (0.36) | HTR2ADRD2SLC6A2HTR2CSLC6A4 | |
| SCHEMBL11816574 | 0.79 | OPRM1 (0.36) | SIGMAR1KCNH2HTR2ADRD2SLC6A2 | |
| SCHEMBL11797763 | 0.79 | SIGMAR1 (0.47) | SIGMAR1KCNH2THRATHRBALDH1A1 |
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-3957988-A | Antiviral compositions containing bis-basic ketones of thioxanthene | RICHARDSON-MERRELL INC. (US) | 1976-05-18 | — | — | US | claimed |
| US-3957988-A | Antiviral compositions containing bis-basic ketones of thioxanthene | RICHARDSON-MERRELL INC. (US) | 1976-05-18 | — | — | US | disclosed |