Guanidine

Guanidine

SCHEMBL8700560

N=C(N)N.O=C(OS(=O)(=O)CCO)c1cc(CO)cc(-n2cccc2)c1

nearest known ligand 0.33

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 8)

geneUniProtsupporting neighboursconfidence
AOC2 O75106 2/20 0.33
VHL P40337 1/20 0.33
ELOC Q15369 1/20 0.33
ELOB Q15370 1/20 0.33
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31

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
Guanidine SCHEMBL8707028 0.86 AOC2 (0.34) AOC2VHLELOCELOBPRSS1
SCHEMBL8700562 0.76 AOC2 (0.36) AOC2VHLELOCELOB
SCHEMBL8707033 0.75 AOC2 (0.35) AOC2VHLELOCELOBPRSS1
SCHEMBL7822637 0.73 CYP4F2 (0.44) AOC2VHLELOCELOBMRGPRX4
SCHEMBL7816169 0.73 SLC9A1 (0.36) AOC2VHLELOCELOBMRGPRX4
SCHEMBL8707029 0.72 AOC2 (0.39) AOC2VHLELOCELOBPRSS1
SCHEMBL8300855 0.72 AOC2 (0.43) AOC2VHLELOCELOBPRSS1
Hydrochloric Acid SCHEMBL8702987 0.71 AOC2 (0.43) AOC2VHLELOCELOBPRSS1
SCHEMBL1388039 0.69 VHL (0.40) AOC2VHLELOCELOBMRGPRX4
Guanidine SCHEMBL8705733 0.68 CA1 (0.36) AOC2

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