BDBM50220407 CHEMBL305338

SMILES: CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1

InChI Key: InChIKey=JXOCVUPTHGIJET-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 = 50220407   

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 (Rattus norvegicus (rat))	BDBM50220407 (CHEMBL305338) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C27H36N2O3/c1-2-3-5-11-26(30)24-12-14-25(15-13-24)32-21-8-16-28-17-19-29(20-18-28)27(31)22-23-9-6-4-7-10-23/h4,6-7,9-10,12-15H,2-3,5,8,11,16-22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity for the rat cortical Histamine H3 receptor				Bioorg Med Chem Lett 12: 2031-4 (2002) BindingDB Entry DOI: 10.7270/Q2MK6G21
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50220407 (CHEMBL305338) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C27H36N2O3/c1-2-3-5-11-26(30)24-12-14-25(15-13-24)32-21-8-16-28-17-19-29(20-18-28)27(31)22-23-9-6-4-7-10-23/h4,6-7,9-10,12-15H,2-3,5,8,11,16-22H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	56	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity for the human Histamine H1 Receptor				Bioorg Med Chem Lett 12: 2031-4 (2002) BindingDB Entry DOI: 10.7270/Q2MK6G21
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50220407 (CHEMBL305338) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C27H36N2O3/c1-2-3-5-11-26(30)24-12-14-25(15-13-24)32-21-8-16-28-17-19-29(20-18-28)27(31)22-23-9-6-4-7-10-23/h4,6-7,9-10,12-15H,2-3,5,8,11,16-22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.91E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity for the human Histamine H2 receptor				Bioorg Med Chem Lett 12: 2031-4 (2002) BindingDB Entry DOI: 10.7270/Q2MK6G21
					More data for this Ligand-Target Pair