BDBM50103089 (4-{(S)-4-[4-(Benzo[1,3]dioxole-5-sulfonyl)-benzyl]-3-methyl-piperazin-1-yl}-piperidin-1-yl)-(2,6-dimethyl-phenyl)-methanone::CHEMBL69581

SMILES: C[C@H]1CN(CCN1Cc1ccc(cc1)S(=O)(=O)c1ccc2OCOc2c1)C1CCN(CC1)C(=O)c1c(C)cccc1C

InChI Key: InChIKey=CWYQMJKOOOYTLH-VWLOTQADSA-N

Data: 2 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 2 hits for monomerid = 50103089   

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
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50103089 ((4-{(S)-4-[4-(Benzo[1,3]dioxole-5-sulfonyl)-benzyl...) Show SMILES C[C@H]1CN(CCN1Cc1ccc(cc1)S(=O)(=O)c1ccc2OCOc2c1)C1CCN(CC1)C(=O)c1c(C)cccc1C Show InChI InChI=1S/C33H39N3O5S/c1-23-5-4-6-24(2)32(23)33(37)34-15-13-27(14-16-34)36-18-17-35(25(3)20-36)21-26-7-9-28(10-8-26)42(38,39)29-11-12-30-31(19-29)41-22-40-30/h4-12,19,25,27H,13-18,20-22H2,1-3H3/t25-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Affinity for Muscarinic acetylcholine receptor M2				Bioorg Med Chem Lett 11: 2143-6 (2001) BindingDB Entry DOI: 10.7270/Q2VQ320K
					More data for this Ligand-Target Pair
C-C chemokine receptor type 5 (Homo sapiens (Human))	BDBM50103089 ((4-{(S)-4-[4-(Benzo[1,3]dioxole-5-sulfonyl)-benzyl...) Show SMILES C[C@H]1CN(CCN1Cc1ccc(cc1)S(=O)(=O)c1ccc2OCOc2c1)C1CCN(CC1)C(=O)c1c(C)cccc1C Show InChI InChI=1S/C33H39N3O5S/c1-23-5-4-6-24(2)32(23)33(37)34-15-13-27(14-16-34)36-18-17-35(25(3)20-36)21-26-7-9-28(10-8-26)42(38,39)29-11-12-30-31(19-29)41-22-40-30/h4-12,19,25,27H,13-18,20-22H2,1-3H3/t25-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	74	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [125I]-labeled RANTES binding to C-C chemokine receptor type 5				Bioorg Med Chem Lett 11: 2143-6 (2001) BindingDB Entry DOI: 10.7270/Q2VQ320K
					More data for this Ligand-Target Pair