Guanidine

Guanidine

SCHEMBL6529495

Cl.Cl.Cl.N=C(N)N.N=C=S

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 SCHEMBL6851202 1.00
Guanidine SCHEMBL27473938 1.00
Guanidine SCHEMBL729040 0.96
Guanidine SCHEMBL27492536 0.96
Guanidine SCHEMBL56028 0.96
Guanidine SCHEMBL29044101 0.96 TSHR (0.31)
Guanidine SCHEMBL1903839 0.96 TSHR (0.31)
Guanidine SCHEMBL7755519 0.92
Guanidine SCHEMBL31206959 0.92
Guanidine SCHEMBL28453453 0.88

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050048509-A1 Diagnosis of invasive mold infection BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2005-03-03 US disclosed
US-20050009051-A1 Diagnosis of mould infection BOARD OF REGENTS, THE UNIVERSITY OF TEXAS 2005-01-13 US disclosed
WO-2004029216-A2 DIAGNOSIS OF INVASIVE MOLD INFECTION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2004-04-08 WO disclosed