Guanidine

Guanidine

SCHEMBL8700429

CS(=O)(=O)OC(=O)c1cccc(-c2ccoc2C#N)c1.N=C(N)N

nearest known ligand 0.36

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
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ASH1L Q9NR48 1/20 0.32
RAB9A P51151 2/20 0.32
MAPK1 P28482 1/20 0.32
F10 P00742 2/20 0.32
F2 P00734 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PLAU P00749 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL8700431 0.81 KAT6A (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7823692 0.81 CHRM2 (0.51) CHRM2CHRM4CHRM5CHRM1CHRM3
Guanidine SCHEMBL8705964 0.79 CA12 (0.35) CA12CA1CA2CA9ASH1L
SCHEMBL7816360 0.78 SLC9A1 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7816358 0.77 SLC9A1 (0.46)
SCHEMBL8705383 0.77 KISS1R (0.35) MAPK1
SCHEMBL8700435 0.76 KAT6A (0.32) CHRM2CHRM4CHRM5CHRM1CHRM3
Guanidine SCHEMBL8699103 0.75 CA12 (0.41) CA12CA1CA2CA9F2
SCHEMBL1387827 0.74 SLC9A1 (0.40)
Guanidine SCHEMBL8703294 0.74 CA12 (0.34) CA12CA1CA2CA9RAB9A

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