BDBM50220458 CHEMBL291847

SMILES: CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)CC(C)C)cc1

InChI Key: InChIKey=SKDLGPGMOATMSN-QHCPKHFHSA-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 = 50220458   

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))	BDBM50220458 (CHEMBL291847) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)CC(C)C)cc1 Show InChI InChI=1S/C25H41N3O3/c1-4-5-6-8-24(29)21-9-11-22(12-10-21)31-18-7-13-27-14-16-28(17-15-27)25(30)23(26)19-20(2)3/h9-12,20,23H,4-8,13-19,26H2,1-3H3/t23-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	170	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 towards Histamine H3 receptor of rat cortical membranes.				Bioorg Med Chem Lett 12: 2035-7 (2002) BindingDB Entry DOI: 10.7270/Q2RB75SX
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50220458 (CHEMBL291847) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)CC(C)C)cc1 Show InChI InChI=1S/C25H41N3O3/c1-4-5-6-8-24(29)21-9-11-22(12-10-21)31-18-7-13-27-14-16-28(17-15-27)25(30)23(26)19-20(2)3/h9-12,20,23H,4-8,13-19,26H2,1-3H3/t23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.77E+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 towards Histamine H1 receptor of human membranes.				Bioorg Med Chem Lett 12: 2035-7 (2002) BindingDB Entry DOI: 10.7270/Q2RB75SX
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50220458 (CHEMBL291847) Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)CC(C)C)cc1 Show InChI InChI=1S/C25H41N3O3/c1-4-5-6-8-24(29)21-9-11-22(12-10-21)31-18-7-13-27-14-16-28(17-15-27)25(30)23(26)19-20(2)3/h9-12,20,23H,4-8,13-19,26H2,1-3H3/t23-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.66E+4	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 towards Histamine H2 receptor from human membranes				Bioorg Med Chem Lett 12: 2035-7 (2002) BindingDB Entry DOI: 10.7270/Q2RB75SX
					More data for this Ligand-Target Pair