Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.49 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4313805 | 0.91 | HRH1 (0.44) | HRH1HSD17B10HTR6CYP1A2CYP2C19 | |
| SCHEMBL3868123 | 0.83 | HTR6 (0.53) | HTR6SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL1436947 | 0.83 | HTR6 (0.51) | HRH1HSD17B10HTR6CYP1A2CYP2C19 | |
| SCHEMBL29849641 | 0.83 | HTR6 (0.51) | HRH1HSD17B10HTR6CYP1A2CYP2C19 | |
| SCHEMBL3874874 | 0.80 | HTR6 (0.53) | HTR6SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL16340383 | 0.77 | HTR6 (0.47) | HTR6ALDH1A1 | |
| SCHEMBL31121639 | 0.76 | HTR6 (0.56) | HTR6 | |
| SCHEMBL2338975 | 0.76 | HTR6 (0.56) | HTR6 | |
| SCHEMBL726512 | 0.76 | HRH1 (0.76) | HRH1NAAAHSD17B10CYP1A2CYP2C19 | |
| SCHEMBL6666869 | 0.76 | HTR6 (0.50) | HRH1HTR6 |
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-4127578-A | Diene intermediates for indantetrols | E. R. SQUIBB & SONS, INC. (US) | 1978-11-28 | — | — | US | disclosed |
| US-4092318-A | HYPOTENSIVES | E. R. SQUIBB & SONS, INC. (US) | 1978-05-30 | — | — | US | disclosed |
| US-4044040-A | HYPERTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1977-08-23 | — | — | US | disclosed |