BDBM50321470 (6-(3-chlorophenoxy)pyridin-3-yl)(4-cyclopropyl-1,4-diazepan-1-yl)methanone::CHEMBL1171001

SMILES: Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1

InChI Key: InChIKey=SASIOZSVIDJSAI-UHFFFAOYSA-N

Data: 2 KI  1 Kd

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 = 50321470   

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))	BDBM50321470 ((6-(3-chlorophenoxy)pyridin-3-yl)(4-cyclopropyl-1,...) Show SMILES Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1 Show InChI InChI=1S/C20H22ClN3O2/c21-16-3-1-4-18(13-16)26-19-8-5-15(14-22-19)20(25)24-10-2-9-23(11-12-24)17-6-7-17/h1,3-5,8,13-14,17H,2,6-7,9-12H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Displacement of [125I]-iodoproxyfan from human recombinant histamine H3 receptor expressed in human SK-N-MC cells after 1 hr by scintillation countin...				Bioorg Med Chem Lett 20: 4210-4 (2010) Article DOI: 10.1016/j.bmcl.2010.05.041 BindingDB Entry DOI: 10.7270/Q29G5NS9
					More data for this Ligand-Target Pair
Histamine H3 receptor (Rattus norvegicus (rat))	BDBM50321470 ((6-(3-chlorophenoxy)pyridin-3-yl)(4-cyclopropyl-1,...) Show SMILES Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1 Show InChI InChI=1S/C20H22ClN3O2/c21-16-3-1-4-18(13-16)26-19-8-5-15(14-22-19)20(25)24-10-2-9-23(11-12-24)17-6-7-17/h1,3-5,8,13-14,17H,2,6-7,9-12H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Binding affinity to histamine H3 receptor in rat brain				Bioorg Med Chem Lett 20: 4210-4 (2010) Article DOI: 10.1016/j.bmcl.2010.05.041 BindingDB Entry DOI: 10.7270/Q29G5NS9
					More data for this Ligand-Target Pair
Histamine H3 receptor (Rattus norvegicus (rat))	BDBM50321470 ((6-(3-chlorophenoxy)pyridin-3-yl)(4-cyclopropyl-1,...) Show SMILES Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1 Show InChI InChI=1S/C20H22ClN3O2/c21-16-3-1-4-18(13-16)26-19-8-5-15(14-22-19)20(25)24-10-2-9-23(11-12-24)17-6-7-17/h1,3-5,8,13-14,17H,2,6-7,9-12H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	11.5	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat histamine H3 receptor expressed in human SK-N-MC cells assessed as inhibition of forskolin-induced cAMP accumulation after...				Bioorg Med Chem Lett 20: 4210-4 (2010) Article DOI: 10.1016/j.bmcl.2010.05.041 BindingDB Entry DOI: 10.7270/Q29G5NS9
					More data for this Ligand-Target Pair