Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 3/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.46 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19043346 | 0.97 | GRIN2B (0.58) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL11782472 | 0.79 | HRH1 (0.58) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL18917604 | 0.78 | LTA4H (0.75) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL11680152 | 0.78 | SIGMAR1 (0.58) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL19980196 | 0.78 | MAOA (0.57) | SLC6A4SLC6A3DRD2SLC6A2 | |
| SCHEMBL5184414 | 0.78 | HRH3 (0.63) | HRH3 | |
| Hydrochloric Acid SCHEMBL11678798 | 0.77 | SIGMAR1 (0.56) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL20382666 | 0.76 | DRD2 (0.48) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL18917601 | 0.75 | SLC6A3 (0.77) | GRIN2BSIGMAR1SLC6A4SLC6A3DRD2 | |
| SCHEMBL6961777 | 0.75 | SIGMAR1 (0.76) | GRIN2BSIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4078066-A | HYPOTENSIVE AGENTS, SURFACTANTS, BACTERICIDES AND WATER SOFTENERS | E. R. SQUIBB & SONS, INC. (US) | 1978-03-07 | — | — | US | disclosed |
| US-4033971-A | HYPOTENSIVES, SURFACTANTS, BACTERICIDES, WATER SOFTENERS | E. R. SQUIBB & SONS, INC. (US) | 1977-07-05 | — | — | US | disclosed |
| US-3936465-A | SURFACTANT, WATER SOFTENER, BACTERICIDE, HYPOTENSIVE | E. R. SQUIBB & SONS, INC. (US) | 1976-02-03 | — | — | US | disclosed |