BDBM50093960 2-(2-Dimethanesulfonylamino-phenyl)-N-methyl-N-((S)-1-phenyl-2-pyrrolidin-1-yl-ethyl)-acetamide::CHEMBL85423

SMILES: CN([C@H](CN1CCCC1)c1ccccc1)C(=O)Cc1ccccc1N(S(C)(=O)=O)S(C)(=O)=O

InChI Key: InChIKey=SSUBKNVHHUYDIV-JOCHJYFZSA-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 = 50093960   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50093960 (2-(2-Dimethanesulfonylamino-phenyl)-N-methyl-N-((S...) Show SMILES CN([C@H](CN1CCCC1)c1ccccc1)C(=O)Cc1ccccc1N(S(C)(=O)=O)S(C)(=O)=O Show InChI InChI=1S/C23H31N3O5S2/c1-24(22(18-25-15-9-10-16-25)19-11-5-4-6-12-19)23(27)17-20-13-7-8-14-21(20)26(32(2,28)29)33(3,30)31/h4-8,11-14,22H,9-10,15-18H2,1-3H3/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description In vitro binding affinity towards Opioid receptor kappa 1 by displacement of bound [3H]U69,593				Bioorg Med Chem Lett 10: 2567-70 (2001) BindingDB Entry DOI: 10.7270/Q26H4GNG
					More data for this Ligand-Target Pair