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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Histamine H4 receptor' and Ligand = 'BDBM189353'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H4 receptor


(Homo sapiens (Human))
BDBM189353
PNG
(4-Benzyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-...)
Show SMILES CN1CCN(CC1)c1nc(N)nc(Cc2ccccc2)n1
Show InChI InChI=1S/C15H20N6/c1-20-7-9-21(10-8-20)15-18-13(17-14(16)19-15)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H2,16,17,18,19)
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Article
PubMed
7.50E+3n/an/an/an/an/an/an/an/a



Department of Technology and Biotechnology of Drugs, Jagiellonian University, Medical College, Medyczna 9, PL 30-688 Kraków, Poland. Electronic address: dlazewska@cm-uj.krakow.pl.

Curated by ChEMBL


Assay Description
Displacement of [3H]-histamine from human histamine H4R expressed in insect Sf9 cell membranes co-expressing Galphai2 and Gbeta1gamma2 after 60 mins ...


Eur J Med Chem 135: 117-124 (2017)


Article DOI: 10.1016/j.ejmech.2017.04.033
BindingDB Entry DOI: 10.7270/Q2QN696C
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM189353
PNG
(4-Benzyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-...)
Show SMILES CN1CCN(CC1)c1nc(N)nc(Cc2ccccc2)n1
Show InChI InChI=1S/C15H20N6/c1-20-7-9-21(10-8-20)15-18-13(17-14(16)19-15)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H2,16,17,18,19)
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Article
PubMed
7.50E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Palermo

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from human H4R expressed in Sf9 cell membranes co-expressed with G protein Gai2 and Gb1gamma2 incubated for 60 mins by ...


Eur J Med Chem 142: 523-549 (2017)


Article DOI: 10.1016/j.ejmech.2017.09.035
BindingDB Entry DOI: 10.7270/Q2HH6NRF
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM189353
PNG
(4-Benzyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-...)
Show SMILES CN1CCN(CC1)c1nc(N)nc(Cc2ccccc2)n1
Show InChI InChI=1S/C15H20N6/c1-20-7-9-21(10-8-20)15-18-13(17-14(16)19-15)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H2,16,17,18,19)
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Article
PubMed
7.50E+3 -27.2n/an/an/an/an/a7.44



Jagiellonian University Medical College



Assay Description
Prior to the experiments, cell membranes were sedimented by a 10 min centrifugation at 4 °C and 16 0009x g and resuspended in binding buffer (12...


Chem Biol Drug Des 88: 254-63 (2016)


Article DOI: 10.1111/cbdd.12752
BindingDB Entry DOI: 10.7270/Q21R6P93
More data for this
Ligand-Target Pair