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SMILES: CN(C)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12

InChI Key: InChIKey=JJMSSEGSJZIYCX-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 294462   
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 H3 receptor


(Homo sapiens (Human))		BDBM294462
PNG
(US9586959, Compound 85)
Show SMILES CN(C)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-19(2)9-5-20(6-9)12-13-18-16-7-21(13)10-3-8(14)4-15-11(10)17-12/h3-4,7,9H,5-6H2,1-2H3
PDB

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US Patent
n/an/a>1.00E+8n/an/an/an/a7.427



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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...

US Patent US9586959 (2017)


BindingDB Entry DOI: 10.7270/Q2C53NWD
More data for this
Ligand-Target Pair