BDBM294433 US9586959, Compound 9

SMILES: CN(C)[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12

InChI Key: InChIKey=YPTSSSOPRLTPQF-SNVBAGLBSA-N

Data: 1 IC50

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 1 hit for monomerid = 294433   

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))	BDBM294433 (US9586959, Compound 9) Show SMILES CN(C)[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12 |r| Show InChI InChI=1S/C14H16ClN7/c1-20(2)10-3-4-21(7-10)13-14-19-17-8-22(14)11-5-9(15)6-16-12(11)18-13/h5-6,8,10H,3-4,7H2,1-2H3/t10-/m1/s1	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