Guanidine

Guanidine

SCHEMBL8699879

CO/N=C/c1cccn1-c1cccc(C(=O)OS(C)(=O)=O)c1.N=C(N)N

nearest known ligand 0.47

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 11/20 0.47
POLB P06746 10/20 0.47
TDP1 Q9NUW8 9/20 0.47
APEX1 P27695 7/20 0.47
MAPT P10636 7/20 0.47
RECQL P46063 5/20 0.47
CTDSP1 Q9GZU7 3/20 0.47
NSD2 O96028 2/20 0.47
NR4A1 P22736 1/20 0.47
MAPK1 P28482 1/20 0.47
PTPN7 P35236 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HTT P42858 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.37
PKM P14618 2/20 0.36
CYP1A2 P05177 1/20 0.34
TP53 P04637 1/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL8699884 0.83 L3MBTL1 (0.46) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7825527 0.83 L3MBTL1 (0.56) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7825532 0.83 L3MBTL1 (0.56) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7827403 0.83 L3MBTL1 (0.56) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7823379 0.81 L3MBTL1 (0.47) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7823376 0.81 L3MBTL1 (0.47) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL7823383 0.80 L3MBTL1 (0.44) L3MBTL1POLBTDP1APEX1MAPT
SCHEMBL8699888 0.78 L3MBTL1 (0.43) L3MBTL1POLBTDP1APEX1MAPT
Guanidine SCHEMBL8700709 0.77 POLB (0.34) L3MBTL1POLBTDP1APEX1MAPT
Guanidine SCHEMBL8705526 0.76 AOC2 (0.49) L3MBTL1POLBTDP1MAPTCTDSP1

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
US-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 US disclosed