Guanidine

Guanidine

SCHEMBL8700255

CS(=O)(=O)OC(=O)c1cccc(C(=O)c2ccccc2)c1.N=C(N)N

nearest known ligand 0.51

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
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
STS P08842 6/20 0.48
PBRM1 Q86U86 1/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CTSL P07711 2/20 0.42
CTSK P43235 1/20 0.42
CA9 Q16790 1/20 0.42
PTGS1 P23219 3/20 0.40
PTGS2 P35354 3/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CXCR1 P25024 1/20 0.40
CXCR2 P25025 1/20 0.40
RECQL P46063 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL9343106 0.83 POLB (0.50) ATMTDP1L3MBTL1STSCA1
SCHEMBL1020413 0.78 TSHR (0.56) TDP1L3MBTL1MAPTSMN1; SMN2ALDH1A1
Guanidine SCHEMBL8705526 0.77 AOC2 (0.49) TDP1L3MBTL1MAPTALDH1A1
Guanidine SCHEMBL8703816 0.77 CA12 (0.44) TDP1CA1CA2CA9ALDH1A1
SCHEMBL27474916 0.77 POLB (0.61) CA1CA2CA9PTGS2SMN1; SMN2
SCHEMBL7339512 0.76 ALDH1A1 (0.52) CA1CA2CA9MAPTSMN1; SMN2
SCHEMBL27647867 0.76 TSHR (0.54) TDP1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL27668297 0.76 TSHR (0.54) TDP1L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL22589065 0.75 PBRM1 (0.49) TDP1PBRM1CA1CA2CA9
SCHEMBL8700256 0.74 L3MBTL1 (0.51) ATMTDP1L3MBTL1STSPBRM1

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