Guanidine

Guanidine

SCHEMBL28136455

COC(=O)O.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
Carbamic Acid SCHEMBL27831134 0.86
Urea SCHEMBL27489102 0.86
SCHEMBL9486350 0.82
Methylamine SCHEMBL2474853 0.82
SCHEMBL27553773 0.82 ALDH1A1 (0.54)
SCHEMBL37752 0.82
Guanidine SCHEMBL28136453 0.80 ALDH1A1 (0.39)
Acetic Acid Methyl Ester SCHEMBL27470817 0.80
Bicarbonate SCHEMBL27808397 0.80 ALDH1A1 (0.39)
Bicarbonate SCHEMBL1147215 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104291328-B Method for grading and separating graphene materials 深圳粤网节能技术服务有限公司 2017-04-12 CN disclosed