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SMILES: NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12

InChI Key: InChIKey=HRGIIIWIMGJNML-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 294432   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Histamine H3 receptor (Homo sapiens (Human))	BDBM294432 (US9586959, Compound 8) Show SMILES NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12 Show InChI InChI=1S/C11H10ClN7/c12-6-1-8-9(14-2-6)16-10(18-3-7(13)4-18)11-17-15-5-19(8)11/h1-2,5,7H,3-4,13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+8	n/a	n/a	n/a	n/a	7.4	27
C&C RESEARCH LABORATORIES 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
Histamine H3 receptor (Homo sapiens (Human))	BDBM294432 (US9586959, Compound 8) Show SMILES NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12 Show InChI InChI=1S/C11H10ClN7/c12-6-1-8-9(14-2-6)16-10(18-3-7(13)4-18)11-17-15-5-19(8)11/h1-2,5,7H,3-4,13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of [3H]-N-alpha-methylhistamine from recombinant human histamine H3 receptor expressed in CHO-K1 cell membranes measured after 30 mins b...				Citation and Details Article DOI: 10.1021/acs.jmedchem.7b01855 BindingDB Entry DOI: 10.7270/Q2ZG6WZQ
					More data for this Ligand-Target Pair
Histamine H4 receptor (Homo sapiens (Human))	BDBM294432 (US9586959, Compound 8) Show SMILES NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12 Show InChI InChI=1S/C11H10ClN7/c12-6-1-8-9(14-2-6)16-10(18-3-7(13)4-18)11-17-15-5-19(8)11/h1-2,5,7H,3-4,13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of [3H]-histamine from recombinant human histamine H4 receptor expressed in CHO-K1 cell membranes measured after 30 mins by microbeta sc...				Citation and Details Article DOI: 10.1021/acs.jmedchem.7b01855 BindingDB Entry DOI: 10.7270/Q2ZG6WZQ
					More data for this Ligand-Target Pair