BDBM50433359 CHEMBL2376804

SMILES: CNC1CN(C1)c1nc(N)nc2cc(cnc12)C1CC1

InChI Key: InChIKey=KICLSPYVVBSUFF-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50433359   

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 H4 Receptor (Mus musculus (mouse))	BDBM50433359 (CHEMBL2376804) Show SMILES CNC1CN(C1)c1nc(N)nc2cc(cnc12)C1CC1 Show InChI InChI=1S/C14H18N6/c1-16-10-6-20(7-10)13-12-11(18-14(15)19-13)4-9(5-17-12)8-2-3-8/h4-5,8,10,16H,2-3,6-7H2,1H3,(H2,15,18,19)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffin Discoveries BV Curated by ChEMBL					Assay Description Binding affinity to mouse histamine H4 receptor				Bioorg Med Chem Lett 23: 2663-70 (2013) Article DOI: 10.1016/j.bmcl.2013.02.091 BindingDB Entry DOI: 10.7270/Q2K35W11
					More data for this Ligand-Target Pair
Histamine H4 Receptor (Rattus norvegicus (rat))	BDBM50433359 (CHEMBL2376804) Show SMILES CNC1CN(C1)c1nc(N)nc2cc(cnc12)C1CC1 Show InChI InChI=1S/C14H18N6/c1-16-10-6-20(7-10)13-12-11(18-14(15)19-13)4-9(5-17-12)8-2-3-8/h4-5,8,10,16H,2-3,6-7H2,1H3,(H2,15,18,19)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffin Discoveries BV Curated by ChEMBL					Assay Description Binding affinity to rat histamine H4 receptor				Bioorg Med Chem Lett 23: 2663-70 (2013) Article DOI: 10.1016/j.bmcl.2013.02.091 BindingDB Entry DOI: 10.7270/Q2K35W11
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50433359 (CHEMBL2376804) Show SMILES CNC1CN(C1)c1nc(N)nc2cc(cnc12)C1CC1 Show InChI InChI=1S/C14H18N6/c1-16-10-6-20(7-10)13-12-11(18-14(15)19-13)4-9(5-17-12)8-2-3-8/h4-5,8,10,16H,2-3,6-7H2,1H3,(H2,15,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.09E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffin Discoveries BV Curated by ChEMBL					Assay Description Displacement of [3H]histamine from human histamine H1 receptor expressed in HEK cells				Bioorg Med Chem Lett 23: 2663-70 (2013) Article DOI: 10.1016/j.bmcl.2013.02.091 BindingDB Entry DOI: 10.7270/Q2K35W11
					More data for this Ligand-Target Pair