Known targets — ChEMBL curated mechanism
KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2
The experimentally established mechanism targets of Guanidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Guanidine SCHEMBL27359865 | 0.94 | — | — | |
| Guanidine SCHEMBL28928092 | 0.94 | — | — | |
| Guanidine SCHEMBL27892632 | 0.88 | NOS1 (0.46) | — | |
| Guanidine SCHEMBL563326 | 0.88 | — | — | |
| Guanidine SCHEMBL29983942 | 0.87 | — | — | |
| Guanidine SCHEMBL5613752 | 0.87 | — | — | |
| Guanidine SCHEMBL165720 | 0.87 | NOS2 (0.42) | — | |
| Guanidine SCHEMBL2003 | 0.87 | — | — | |
| Guanidine SCHEMBL11330173 | 0.87 | — | — | |
| Guanidine SCHEMBL28923883 | 0.82 | — | — |
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 140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106608876-B | A kind of preparation method of high-purity Pa Boxini | 新发药业有限公司 | 2018-06-19 | — | — | CN | claimed |
| CN-106608876-A | Preparation method of high-purity palbociclib | 新发药业有限公司 | 2017-05-03 | — | — | CN | claimed |
| CN-104230899-A | Ethyl prosulfuron as well as preparation method and application thereof | NIE SHIBAO | 2014-12-24 | — | — | CN | claimed |
| CN-106608876-B | A kind of preparation method of high-purity Pa Boxini | 新发药业有限公司 | 2018-06-19 | — | — | CN | disclosed |
| CN-107382788-A | A kind of preparation method of 1,2 dinitro guanidine | 南通天泽化工有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-106795104-A | Improved process for preparing high purity metformin | 瑟勒特·库玛·卡玛瓦拉普 | 2017-05-31 | — | — | CN | disclosed |
| CN-106608876-A | Preparation method of high-purity palbociclib | 新发药业有限公司 | 2017-05-03 | — | — | CN | disclosed |
| CN-104230899-A | Ethyl prosulfuron as well as preparation method and application thereof | NIE SHIBAO | 2014-12-24 | — | — | CN | disclosed |
| US-8143307-B2 | Benzothiophen-2-carbonylguanidine derivatives, preparation thereof, and pharmaceutical composition containing the same | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2012-03-27 | — | — | US | disclosed |
| EP-1259481-B1 | SUBSTITUTED BENZOYLGUANIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE AS A MEDICAMENT OR DIAGNOSTIC AGENT AND A MEDICAMENT CONTAINING THE SAME | SANOFI AVENTIS DEUTSCHLAND (DE) | 2011-10-26 | — | — | EP | disclosed |
| CN-101137641-B | Benzothiophen-2-carbonylguanidine derivatives, preparation thereof, and pharmaceutical composition containing the same | KOREA RES INST CHEM TECH | 2010-11-24 | — | — | CN | disclosed |
| EP-0602522-A1 | Substituted Benzoylguanidines, method for their preparation, their use as antiarrhythmic agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-22 | — | — | EP | disclosed |
| EP-0602523-A1 | Substituted benzoylguanidines, process for their preparation, their use as medicament or diagnostic agent, as well as a medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-22 | — | — | EP | disclosed |
| EP-0600371-A1 | Guanidinyl alkyl-1,1- bis phosphonic acid derivatives, process for their preparation and use | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-08 | — | — | EP | disclosed |
| EP-0589336-A1 | Benzoylguanidines, process for their preparation and their use as antiarrhythmic agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0577024-A1 | 3,4,5 substituted benzoylguanidines, process for their preparation, their use as medicament or diagnostic agent, as well as a medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-01-05 | — | — | EP | disclosed |
| EP-0556673-A1 | Ortho-substituted benzoylguanidines for the treatment and prophylaxis of heart-rhythm disorders and ischaemically induced damage, as well as inhibition of cell proliferation | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-08-25 | — | — | EP | disclosed |
| EP-0556674-A1 | 3,5-substituted benzoylguanidines with antiarrhythmic activity and cell proliferation inhibiting activity | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-08-25 | — | — | EP | disclosed |
| EP-0416499-A2 | Benzoylguanidines, process for their preparation, their use as medicaments as well as medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-03-13 | — | — | EP | disclosed |
| US-4125575-A | Phosphonylated amides | COMPAGNIE FRANCAISE DE PRODUITS INDUSTRIELS (FR) | 1978-11-14 | — | — | US | disclosed |