Guanidine

Guanidine

SCHEMBL4648758

Br.Cl.N=C(N)N.N=C(N)N

nearest known ligand 0.38

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
HRH4 Q9H3N8 2/20 0.38
NOS2 P35228 2/20 0.36
MAPK1 P28482 1/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
BLM P54132 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
CYP3A4 P08684 2/20 0.33
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 1/20 0.33
LMNA P02545 2/20 0.32
APEX1 P27695 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.31
PRSS1 P07477 2/20 0.30
PRSS3 P35030 2/20 0.30
PRSS2 P07478 1/20 0.30
C1S P09871 1/20 0.30
RECQL P46063 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
Guanidine SCHEMBL17967024 0.94 HRH4 (0.35) HRH4NOS2MAPK1NOS3NOS1
Guanidine SCHEMBL17184362 0.94 NOS2 (0.39) HRH4NOS2MAPK1NOS3NOS1
Guanidine SCHEMBL5053878 0.94 NOS2 (0.39) HRH4NOS2MAPK1NOS3NOS1
Guanidine SCHEMBL29088714 0.94 NOS2 (0.39) HRH4NOS2MAPK1NOS3NOS1
Guanidine SCHEMBL2453389 0.94
Guanidine SCHEMBL19610646 0.94 NOS2 (0.39) HRH4NOS2MAPK1NOS3NOS1
Guanidine SCHEMBL3349156 0.94
Guanidine SCHEMBL8024162 0.94
Guanidine SCHEMBL2340600 0.94
Guanidine SCHEMBL395351 0.94 NOS2 (0.39) HRH4NOS2MAPK1NOS3NOS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960408-A1 PROCESS FOR THE PRODUCTION OF MERCAPTOALKYLALKOXYSILANES Momentive Performance Materials Inc. (US) 2008-08-27 EP disclosed
EP-1869057-A2 AQUEOUS CATALYTIC PROCESS FOR THE PREPARATION OF THIOCARBOXYLATE SILANE General Electric Company (US) 2007-12-26 EP disclosed
WO-2007058979-A1 PROCESS FOR THE PRODUCTION OF MERCAPTOALKYLALKOXYSILANES MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-05-24 WO disclosed
WO-2006113122-A2 AQUEOUS CATALYTIC PROCESS FOR THE PREPARATION OF THIOCARBOXYLATE SILANE GENERAL ELECTRIC COMPANY (US) 2006-10-26 WO disclosed