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BDBM22883 CHEMBL12344::Dimaprit::[3-(carbamimidoylsulfanyl)propyl]dimethylamine

SMILES: CN(C)CCCSC(N)=N

InChI Key: InChIKey=OLHQOJYVQUNWPL-UHFFFAOYSA-N

Data: 8 KI  1 Kd

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 22883   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H4 receptor


(Homo sapiens (Human))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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PubMed
90n/an/an/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from human histamine H4 receptor expressed in SK-NM-C cells


J Med Chem 51: 3145-53 (2008)


Article DOI: 10.1021/jm7014777
BindingDB Entry DOI: 10.7270/Q2M046BP
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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316 -9.22n/an/an/an/an/a7.437



Vrije Universiteit Amsterdam



Assay Description
Ligand displacement assays were performed on The SK-N-MC/hH4R cell homogenates. Retained radioactivity was determined by liquid scintillation countin...


J Pharmacol Exp Ther 314: 1310-21 (2005)


Article DOI: 10.1124/jpet.105.087965
BindingDB Entry DOI: 10.7270/Q2KD1W6V
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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377n/an/an/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by PDSP Ki Database




Mol Pharmacol 59: 420-6 (2001)


Article DOI: 10.1111/cbdd.12713
BindingDB Entry DOI: 10.7270/Q26Q1VSR
More data for this
Ligand-Target Pair
HRH3


(RAT)
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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440n/an/an/an/an/an/an/an/a



Schering-Plough Research

Curated by PDSP Ki Database




J Neurochem 55: 1612-6 (1990)


Article DOI: 10.1111/j.1471-4159.1990.tb04946.x
BindingDB Entry DOI: 10.7270/Q2X63KF2
More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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825n/an/an/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by PDSP Ki Database




Mol Pharmacol 59: 420-6 (2001)


Article DOI: 10.1111/cbdd.12713
BindingDB Entry DOI: 10.7270/Q26Q1VSR
More data for this
Ligand-Target Pair
Histamine H2 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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>1.00E+4n/an/an/an/an/an/an/an/a



Hoechst Pharmaceutical Research Laboratories

Curated by PDSP Ki Database




Nature 304: 65-7 (1983)


BindingDB Entry DOI: 10.7270/Q2930RN2
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Centre for Addiction and Mental Health

Curated by PDSP Ki Database




Mol Pharmacol 59: 427-33 (2001)


Article DOI: 10.1021/acschembio.5b00640
BindingDB Entry DOI: 10.7270/Q22Z1438
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Histamine H2 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22883
PNG
(CHEMBL12344 | Dimaprit | [3-(carbamimidoylsulfanyl...)
Show SMILES CN(C)CCCSC(N)=N
Show InChI InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)
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n/an/an/a 2.63E+4n/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Compound is evaluated for histamine H2 receptor agonistic activity in guinea pig cerebral cortex using [3H]tiotidine as radioligand


J Med Chem 35: 3239-46 (1992)


BindingDB Entry DOI: 10.7270/Q2C53N4J
More data for this
Ligand-Target Pair