Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 11/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HRH2 | P25021 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | ATP4A | P20648 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ATP4B | P51164 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11372646 | 1.00 | QPCT (0.47) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL11527371 | 0.89 | QPCT (0.51) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL9777094 | 0.82 | QPCT (0.48) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL11527455 | 0.81 | BCHE (0.35) | QPCTHRH4HRH3BCHEACHE | |
| SCHEMBL11192767 | 0.80 | HRH4 (0.46) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL9436268 | 0.80 | QPCT (0.47) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL9435604 | 0.80 | QPCT (0.47) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL10564976 | 0.80 | QPCT (0.47) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL10564978 | 0.80 | QPCT (0.47) | QPCTHRH4HRH3CYP3A4CYP2D6 | |
| SCHEMBL11511268 | 0.78 | QPCT (0.32) | QPCTHRH4HRH3 |
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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114394939-A | Synthesis method of cimetidine | 河北科技大学 | 2022-04-26 | — | — | CN | claimed |
| EP-0046635-B1 | PROCESS FOR THE PREPARATION OF CIMETIDINE | ORION-YHTYMÄ OY (FI) | 1985-07-03 | — | — | EP | claimed |
| EP-0058286-A1 | Geometrical isomers of cyano-guanidines, and processes for their preparation | Société de Recherches et de Synthèses Organiques SA (CH) | 1982-08-25 | — | — | EP | claimed |
| EP-0046635-A1 | Process for the preparation of cimetidine | ORION-YHTYMÄ OY (FI) | 1982-03-03 | — | — | EP | claimed |
| JP-57091978-A | — | — | None | — | — | JP | disclosed |
| JP-63045266-A | — | — | None | — | — | JP | disclosed |
| JP-58188855-A | — | — | None | — | — | JP | disclosed |
| JP-59190973-A | — | — | None | — | — | JP | disclosed |
| JP-59128375-A | — | — | None | — | — | JP | disclosed |
| CN-114394939-A | Synthesis method of cimetidine | 河北科技大学 | 2022-04-26 | — | — | CN | disclosed |
| EP-0261818-B1 | PROCESS FOR PREPARATION OF GUANIDINE DERIVATIVE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-12-11 | — | — | EP | disclosed |
| US-4973703-A | ACTIVATED CARBON IN WATER IN PRESENCE OR ORGANIC ACID | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1990-11-27 | — | — | US | disclosed |
| US-4276421-A | Cyano-guanidine geometrical isomers | SOCIETE DE RECHERCHES ET DE SYNTHESES ORGANIQUES S.A. (CH) | 1981-06-30 | — | — | US | disclosed |
| US-4267337-A | Imidazolemethylphosphonium salts | SK&F LAB CO. (US) | 1981-05-12 | — | — | US | disclosed |
| US-4255440-A | ANTIALLERGENS, ANTIULCER AGENTS | ALLEN & HANBURYS LIMITED (GB) | 1981-03-10 | — | — | US | disclosed |
| US-4215217-A | Process for preparing 4-substituted imidazole compounds | SK&F LAB CO. (US) | 1980-07-29 | — | — | US | disclosed |
| US-4171325-A | Chemical process | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1979-10-16 | — | — | US | disclosed |
| US-4169855-A | ANTIHISTAMINES, ANTISECRETORY AGENTS | Allen & Hansbury, Limited (GB) | 1979-10-02 | — | — | US | disclosed |
| US-4128658-A | HISTAMINE ANTAGONISTS | ALLEN & HANBURYS LIMITED (GB) | 1978-12-05 | — | — | US | disclosed |
| US-4119781-A | Process for preparing 4-substituted imidazole compounds | SK&F LAB CO. (US) | 1978-10-10 | — | — | US | disclosed |