BDBM50345081 (1,4-diazepan-1-yl)(5-fluoro-1-(4-methoxy-2,3-dimethylphenylsulfonyl)-2-methyl-1H-indol-3-yl)methanone::CHEMBL1779233

SMILES: COc1ccc(c(C)c1C)S(=O)(=O)n1c(C)c(C(=O)N2CCCNCC2)c2cc(F)ccc12

InChI Key: InChIKey=PXMOMZIFWWUXHR-UHFFFAOYSA-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 1 hit for monomerid = 50345081   

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))	BDBM50345081 ((1,4-diazepan-1-yl)(5-fluoro-1-(4-methoxy-2,3-dime...) Show SMILES COc1ccc(c(C)c1C)S(=O)(=O)n1c(C)c(C(=O)N2CCCNCC2)c2cc(F)ccc12 Show InChI InChI=1S/C24H28FN3O4S/c1-15-16(2)22(9-8-21(15)32-4)33(30,31)28-17(3)23(19-14-18(25)6-7-20(19)28)24(29)27-12-5-10-26-11-13-27/h6-9,14,26H,5,10-13H2,1-4H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	310	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
MSD Curated by ChEMBL					Assay Description Displacement of [3H]-AVP from human vasopressin V1B receptor expressed in CHO cells				Bioorg Med Chem Lett 21: 3603-7 (2011) Article DOI: 10.1016/j.bmcl.2011.04.104 BindingDB Entry DOI: 10.7270/Q2833SCQ
					More data for this Ligand-Target Pair