Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.47 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.41 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182602 | 1.00 | GRIK1 (0.47) | GRIK1GRIA2HRH3KCNH2PTPN7 | |
| SCHEMBL27813547 | 1.00 | GRIK1 (0.47) | GRIK1GRIA2HRH3KCNH2PTPN7 | |
| SCHEMBL12571288 | 0.88 | HRH3 (0.43) | HRH3KCNH2 | |
| SCHEMBL6943424 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL29380816 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL3448482 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL3448485 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL3180028 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL13584955 | 0.85 | HRH3 (0.54) | GRIK1GRIA2HRH3 | |
| SCHEMBL13357840 | 0.85 | IKBKB (0.55) | GRIK1GRIA2HRH3KCNH2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4325943-A | HYPOTENSIVE AGENTS, DIURETICS | E. R. SQUIBB & SONS, INC. (US) | 1982-04-20 | — | — | US | claimed |
| US-4284624-A | HYPOTENSIVE PEPTIDES | E. R. SQUIBB & SONS, INC. (US) | 1981-08-18 | — | — | US | claimed |
| US-4462943-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1984-07-31 | — | — | US | disclosed |
| EP-0052991-A1 | Carboxyalkyl amino acid derivatives of various substituted prolines | E.R. Squibb & Sons, Inc. (US) | 1982-06-02 | — | — | EP | disclosed |
| US-4316906-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1982-02-23 | — | — | US | disclosed |