Guanidine

Guanidine

SCHEMBL8700709

CS(=O)(=O)OC(=O)c1cccc(-n2cccc2C#N)c1.N=C(N)N

nearest known ligand 0.34

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
POLB P06746 7/20 0.34
L3MBTL1 Q9Y468 6/20 0.34
TDP1 Q9NUW8 4/20 0.34
APEX1 P27695 4/20 0.34
RECQL P46063 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TP53 P04637 1/20 0.33
MAPT P10636 4/20 0.33
NSD2 O96028 1/20 0.33
NR4A1 P22736 1/20 0.33
MAPK1 P28482 1/20 0.33
PTPN7 P35236 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
F2 P00734 2/20 0.33
F10 P00742 2/20 0.33
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 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
Guanidine SCHEMBL8704968 0.85 F2 (0.33) POLBL3MBTL1TDP1APEX1RECQL
Guanidine SCHEMBL8706280 0.84 ALDH1A1 (0.42) POLBL3MBTL1TDP1RECQLMEN1
SCHEMBL8700712 0.80 AOC2 (0.36) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL7826960 0.80 TP53 (0.48) L3MBTL1TP53MAPTMAPK1ALDH1A1
Guanidine SCHEMBL8705526 0.79 AOC2 (0.49) POLBL3MBTL1TDP1KMT2ATP53
Guanidine SCHEMBL8704972 0.78 POLB (0.36) POLBL3MBTL1TDP1APEX1RECQL
Guanidine SCHEMBL8700193 0.78 POLB (0.36) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL7827019 0.77 SLC9A1 (0.33) POLBL3MBTL1TDP1APEX1RECQL
Guanidine SCHEMBL8699879 0.77 L3MBTL1 (0.47) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL7827018 0.77 SLC9A1 (0.44)

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