Guanidine

Guanidine

SCHEMBL9110704

C.N=C(N)N

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

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.

Compoundsimilaritytop predictedshared targets
Guanidine SCHEMBL28214616 0.94
Guanidine SCHEMBL5613752 0.93
Guanidine SCHEMBL29983942 0.93
Guanidine SCHEMBL2003 0.93
Guanidine SCHEMBL11330173 0.93
Guanidine SCHEMBL165720 0.93 NOS2 (0.42)
Guanidine SCHEMBL25310528 0.86
Guanidine SCHEMBL66976 0.86
Guanidine SCHEMBL10418561 0.86
Guanidine SCHEMBL3349156 0.86

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3894417-B1 NOVEL GALLIUM COMPOUNDS AND THEIR USE UNIV BIELEFELD (DE) 2022-12-07 EP disclosed
US-11330999-B2 Hyperpolarized and deuterium exchanged hyperpolarized13C and 15N-labeled xanthine, arginine, glutamine, and urea probes MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-05-17 US disclosed
US-20200260983-A1 HYPERPOLARIZED AND DEUTERIUM EXCHANGED HYPERPOLARIZED13C AND 15N-LABELED XANTHINE, ARGININE, GLUTAMINE, AND UREA PROBES MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2020-08-20 US disclosed
EP-3692013-A1 HYPERPOLARIZED AND DEUTERIUM EXCHANGED HYPERPOLARIZED13C AND 15N-LABELED XANTHINE, ARGININE, GLUTAMINE, AND UREA PROBES Memorial Sloan-Kettering Cancer Center (US) 2020-08-12 EP disclosed
WO-2019055358-A1 HYPERPOLARIZED AND DEUTERIUM EXCHANGED HYPERPOLARIZED13C AND 15N-LABELED XANTHINE, ARGININE, GLUTAMINE, AND UREA PROBES MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2019-03-21 WO disclosed
US-8853417-B2 Non-halogen activating agent used as flux HUNAN ASTAR BIOTECHNOLOGY LTD. (CN) 2014-10-07 US disclosed
CN-104053458-A Hydrogel materials comprising eluting ceragenin compounds UNIV BRIGHAM YOUNG 2014-09-17 CN disclosed
CN-104039369-A Hydrophobic ceragenin compounds and devices incorporating same UNIV BRIGHAM YOUNG 2014-09-10 CN disclosed
US-20120142938-A1 Non-halogen activating agent used as flux HUNAN ASTAR BIOTECHNOLOGY LTD (CN) 2012-06-07 US disclosed