BDBM50416630 CHEMBL1223545

SMILES: CC(C)(C)NC(=O)Cn1c(cn2cc(OCCCN3CCCCC3)cc2c1=O)-c1cccc(Cl)c1

InChI Key: InChIKey=ZRSUSJWUZLWDOF-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 = 50416630   

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
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM50416630 (CHEMBL1223545) Show SMILES CC(C)(C)NC(=O)Cn1c(cn2cc(OCCCN3CCCCC3)cc2c1=O)-c1cccc(Cl)c1 Show InChI InChI=1S/C27H35ClN4O3/c1-27(2,3)29-25(33)19-32-24(20-9-7-10-21(28)15-20)18-31-17-22(16-23(31)26(32)34)35-14-8-13-30-11-5-4-6-12-30/h7,9-10,15-18H,4-6,8,11-14,19H2,1-3H3,(H,29,33)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.51	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human vasopressin 1b receptor expressed in CHO cells assessed as inhibition of vasopressin-induced intracellular calcium mobil...				Bioorg Med Chem Lett 20: 5044-9 (2010) Article DOI: 10.1016/j.bmcl.2010.07.037 BindingDB Entry DOI: 10.7270/Q24J0GC3
					More data for this Ligand-Target Pair