BDBM50345069 (S)-2-(4-methoxy-2,3,6-trimethylphenylsulfonamido)-N-((S)-1-oxo-3-phenyl-1-(piperidin-1-yl)propan-2-yl)-3-phenylpropanamide::CHEMBL1779124

SMILES: COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1

InChI Key: InChIKey=QRZXUUGUFFCWRJ-VMPREFPWSA-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 = 50345069   

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))	BDBM50345069 ((S)-2-(4-methoxy-2,3,6-trimethylphenylsulfonamido)...) Show SMILES COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1 |r| Show InChI InChI=1S/C33H41N3O5S/c1-23-20-30(41-4)24(2)25(3)31(23)42(39,40)35-28(21-26-14-8-5-9-15-26)32(37)34-29(22-27-16-10-6-11-17-27)33(38)36-18-12-7-13-19-36/h5-6,8-11,14-17,20,28-29,35H,7,12-13,18-19,21-22H2,1-4H3,(H,34,37)/t28-,29-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	630	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