BDBM50405703 CHEMBL4171151

SMILES: CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1

InChI Key: InChIKey=ONXGVQXINOBGEK-UKMLZYKCSA-N

Data: 1 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 2 hits for monomerid = 50405703   

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))	BDBM50405703 (CHEMBL4171151) Show SMILES CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1 Show InChI InChI=1S/C19H26N2O5S/c1-12(17(22)21-11-14(27-2)10-16(21)19(25)26)20-15(18(23)24)9-8-13-6-4-3-5-7-13/h3-7,12,14-16,20H,8-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,14+,15-,16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405703 (CHEMBL4171151) Show SMILES CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1 Show InChI InChI=1S/C19H26N2O5S/c1-12(17(22)21-11-14(27-2)10-16(21)19(25)26)20-15(18(23)24)9-8-13-6-4-3-5-7-13/h3-7,12,14-16,20H,8-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,14+,15-,16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]Nalpha-methylhistamine from recombinant human H3 receptor expressed in HEK293 cells after 90 mins by liquid scintillation countin...				Eur J Med Chem 152: 223-234 (2018) Article DOI: 10.1016/j.ejmech.2018.04.043 BindingDB Entry DOI: 10.7270/Q2697632
					More data for this Ligand-Target Pair