BDBM294396 US9586959, Compound 62

SMILES: Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21

InChI Key: InChIKey=FEHVAJUHQQKIBN-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 294396   

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))	BDBM294396 (US9586959, Compound 62) Show SMILES Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21 Show InChI InChI=1S/C12H11Cl2N7/c13-7-5-8-10(17-9(7)14)18-11(12-19-16-6-21(8)12)20-3-1-15-2-4-20/h5-6,15H,1-4H2	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 H4 receptor (Homo sapiens (Human))	BDBM294396 (US9586959, Compound 62) Show SMILES Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21 Show InChI InChI=1S/C12H11Cl2N7/c13-7-5-8-10(17-9(7)14)18-11(12-19-16-6-21(8)12)20-3-1-15-2-4-20/h5-6,15H,1-4H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	510	n/a	n/a	n/a	n/a	7.5	25
C&C RESEARCH LABORATORIES US Patent					Assay Description In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...				US Patent US9586959 (2017) BindingDB Entry DOI: 10.7270/Q2C53NWD
					More data for this Ligand-Target Pair