BDBM75566 KSC-11-114-1::KUC105392N::N-[2-[benzyl(tert-butyl)amino]ethyl]-4-[(tosylamino)methyl]benzamide::N-[2-[benzyl(tert-butyl)amino]ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]benzamide::N-[2-[tert-butyl-(phenylmethyl)amino]ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]benzamide::cid_45115589

SMILES: Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C

InChI Key: InChIKey=PSNVTEQUIAAEDR-UHFFFAOYSA-N

Data: 4 KI  9 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 13 hits for monomerid = 75566   

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
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Binding affinity to sigma-1 receptor (unknown origin)				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Binding affinity to muscarinic M4 receptor (unknown origin)				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Binding affinity to muscarinic M3 receptor (unknown origin)				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Binding affinity to muscarinic M2 receptor (unknown origin)				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q26Q1VQV
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of kappa opioid receptor (unknown origin) using dynorphin A by high content imaging beta-arrestin translocation assay				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of kappa opioid receptor (unknown origin) using dynorphin A by DiscoveryRx b-arrestin PathHunter assay				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of delta opioid receptor (unknown origin) using SNC-80 by high content imaging beta-arrestin translocation assay				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2G73C59
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	53.5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2V986J5
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	28.7	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2028Q01
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	76.3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Burnham Institute for Medical Research (BIMR, La Jolla, CA) Network: NIH...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q29S1PHQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM75566 (KSC-11-114-1 | KUC105392N | N-[2-[benzyl(tert-buty...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCCN(Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H35N3O3S/c1-22-10-16-26(17-11-22)35(33,34)30-20-23-12-14-25(15-13-23)27(32)29-18-19-31(28(2,3)4)21-24-8-6-5-7-9-24/h5-17,30H,18-21H2,1-4H3,(H,29,32)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of mu opioid receptor (unknown origin) using DAMGO by high content imaging beta-arrestin translocation assay				Bioorg Med Chem Lett 24: 2021-32 (2014) Article DOI: 10.1016/j.bmcl.2014.03.040 BindingDB Entry DOI: 10.7270/Q2222WBX
					More data for this Ligand-Target Pair