BDBM50419454 CHEMBL1923032

SMILES: CCCCN=C(NCc1ccc(Cl)c(Cl)c1)SCCCc1cnc[nH]1

InChI Key: InChIKey=KADHZYCVSZHNTR-UHFFFAOYSA-N

Data: 2 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 = 50419454   

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))	BDBM50419454 (CHEMBL1923032) Show SMILES CCCCN=C(NCc1ccc(Cl)c(Cl)c1)SCCCc1cnc[nH]1 |w:4.3| Show InChI InChI=1S/C18H24Cl2N4S/c1-2-3-8-22-18(25-9-4-5-15-12-21-13-24-15)23-11-14-6-7-16(19)17(20)10-14/h6-7,10,12-13H,2-5,8-9,11H2,1H3,(H,21,24)(H,22,23)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]histamine from human H3 receptor expressed in HEK293 cells after 1 to 1.5 hrs by scintillation counting				J Med Chem 54: 8136-47 (2011) Article DOI: 10.1021/jm201042n BindingDB Entry DOI: 10.7270/Q2MW2JDX
					More data for this Ligand-Target Pair
Histamine H4 receptor (Homo sapiens (Human))	BDBM50419454 (CHEMBL1923032) Show SMILES CCCCN=C(NCc1ccc(Cl)c(Cl)c1)SCCCc1cnc[nH]1 |w:4.3| Show InChI InChI=1S/C18H24Cl2N4S/c1-2-3-8-22-18(25-9-4-5-15-12-21-13-24-15)23-11-14-6-7-16(19)17(20)10-14/h6-7,10,12-13H,2-5,8-9,11H2,1H3,(H,21,24)(H,22,23)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	89.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]histamine from human H4 receptor expressed in HEK293 cells after 1 to 1.5 hrs by scintillation counting				J Med Chem 54: 8136-47 (2011) Article DOI: 10.1021/jm201042n BindingDB Entry DOI: 10.7270/Q2MW2JDX
					More data for this Ligand-Target Pair