Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10995302 | 0.77 | POLB (0.30) | ALDH1A1POLB | |
| SCHEMBL5174001 | 0.75 | F2 (0.34) | ALDH1A1HTTPOLBSCN9A | |
| SCHEMBL5156822 | 0.72 | NUDT1 (0.38) | ALDH1A1HTTPOLBSCN9A | |
| SCHEMBL7491690 | 0.69 | ALDH1A1 (0.51) | ALDH1A1POLB | |
| SCHEMBL24846283 | 0.68 | ALDH1A1 (0.42) | GAAALDH1A1HTTPOLB | |
| SCHEMBL7487907 | 0.68 | GLS (0.41) | ALDH1A1HTTPOLB | |
| SCHEMBL6275094 | 0.67 | TSHR (0.57) | THRBGAAALDH1A1HTTPOLB | |
| SCHEMBL7699261 | 0.65 | ALDH1A1 (0.51) | GAAALDH1A1HTT | |
| Methane SCHEMBL10992784 | 0.64 | — | — | |
| SCHEMBL8181348 | 0.63 | KMT2A (0.41) | THRBGAAALDH1A1HTTPOLB |
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-4500715-A | CHEMICAL INTERMEDIATES FOR PLANT SAFENING AGENTS AND DYES | BAYER AKTIENGESELLSCHAFT (DE) | 1985-02-19 | — | — | US | disclosed |
| US-4268438-A | Cationic 1,3,4-thiadiazole dyestuffs | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-19 | — | — | US | disclosed |