BDBM50368378 CHEMBL1202943

SMILES: CN(C)CCCN1C(SCC1=O)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=CDJOLKQJMZJKNP-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50368378   

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 H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50368378 (CHEMBL1202943) Show SMILES CN(C)CCCN1C(SCC1=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H19N3O3S/c1-15(2)8-3-9-16-13(18)10-21-14(16)11-4-6-12(7-5-11)17(19)20/h4-7,14H,3,8-10H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Napoli Federico II Curated by ChEMBL					Assay Description In vitro for histamine H1 receptor antagonist activity against histamine-induced contractions on isolated guinea pig ileum				J Med Chem 35: 2910-2 (1992) BindingDB Entry DOI: 10.7270/Q2XK8G4G
					More data for this Ligand-Target Pair