Compile Data Set for Download or QSAR

Found 42 hits Enz. Inhib. hit(s) with all data for entry = 50044406   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50035131 ((+)-(6R,11S)-6,11-dimethyl-3-(3-methyl-but-2-enyl)...) Show SMILES [#6]-[#6@@H]1-[#6@@H]-2-[#6]-c3ccc(-[#8])cc3[C@@]1([#6])[#6]-[#6]-[#7]-2-[#6]\[#6]=[#6](/[#6])-[#6] |r,TLB:16:15:10.4.3:1| Show InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50048866 (1-Cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydro-na...) Show SMILES COc1cccc2C(CCCN3CCN(CC3)C3CCCCC3)CCCc12 Show InChI InChI=1S/C24H38N2O/c1-27-24-14-6-12-22-20(8-5-13-23(22)24)9-7-15-25-16-18-26(19-17-25)21-10-3-2-4-11-21/h6,12,14,20-21H,2-5,7-11,13,15-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in human MCF7 cell membranes after 120 mins				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50035105 (1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...) Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12 Show InChI InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to sigma-1 receptor (unknown origin)				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Mus musculus (Mouse))	BDBM50216057 (CHEMBL226539 | N-[6,7-dimethoxy-3,4-dihydro-1H-iso...) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(C)ccc3OCCF)Cc2cc1OC Show InChI InChI=1S/C25H33FN2O4/c1-18-6-7-22(32-13-9-26)21(14-18)25(29)27-10-4-5-11-28-12-8-19-15-23(30-2)24(31-3)16-20(19)17-28/h6-7,14-16H,4-5,8-13,17H2,1-3H3,(H,27,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of 5-bromo-N-(4-(3,4-dihydro-6,7-dimethoxyisoquinolin-2(1H)-yl)butyl)-2,3-dimethoxybenzamide from sigma-1 receptor in mouse EMT6 cell me...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Mus musculus (Mouse))	BDBM50216055 (CHEMBL387741 | N-[4-(6,7-dimethoxy-3,4-dihydro-1H-...) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(I)ccc3OCCF)Cc2cc1OC Show InChI InChI=1S/C24H30FIN2O4/c1-30-22-13-17-7-11-28(16-18(17)14-23(22)31-2)10-4-3-9-27-24(29)20-15-19(26)5-6-21(20)32-12-8-25/h5-6,13-15H,3-4,7-12,16H2,1-2H3,(H,27,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of 5-bromo-N-(4-(3,4-dihydro-6,7-dimethoxyisoquinolin-2(1H)-yl)butyl)-2,3-dimethoxybenzamide from sigma-1 receptor in mouse EMT6 cell me...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016290 (CHEMBL3262787) Show SMILES COc1cccc(Cn2cc(nn2)-c2cccc(c2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)c1 Show InChI InChI=1S/C32H37N5O4/c1-39-28-11-6-8-23(16-28)20-37-22-29(34-35-37)25-9-7-10-26(17-25)32(38)33-13-4-5-14-36-15-12-24-18-30(40-2)31(41-3)19-27(24)21-36/h6-11,16-19,22H,4-5,12-15,20-21H2,1-3H3,(H,33,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50016262 (CHEMBL3262795) Show SMILES [H][C@@]12C[C@](CCN1C)(CC\C2=C\c1ccccc1)c1cccc(O)c1 |r| Show InChI InChI=1S/C22H25NO/c1-23-13-12-22(19-8-5-9-20(24)15-19)11-10-18(21(23)16-22)14-17-6-3-2-4-7-17/h2-9,14-15,21,24H,10-13,16H2,1H3/b18-14-/t21?,22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to sigma-1 receptor (unknown origin)				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Mus musculus (Mouse))	BDBM50137628 (CHEMBL1830682 | CHEMBL60048 | N-(4-(6,7-dimethoxy-...) Show SMILES COc1ccc(C)cc1C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C24H32N2O4/c1-17-7-8-21(28-2)20(13-17)24(27)25-10-5-6-11-26-12-9-18-14-22(29-3)23(30-4)15-19(18)16-26/h7-8,13-15H,5-6,9-12,16H2,1-4H3,(H,25,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.08E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of 5-bromo-N-(4-(3,4-dihydro-6,7-dimethoxyisoquinolin-2(1H)-yl)butyl)-2,3-dimethoxybenzamide from sigma-1 receptor in mouse EMT6 cell me...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016272 (CHEMBL3262523) Show SMILES COc1ccc(Cn2cc(nn2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)cc1 Show InChI InChI=1S/C26H33N5O4/c1-33-22-8-6-19(7-9-22)16-31-18-23(28-29-31)26(32)27-11-4-5-12-30-13-10-20-14-24(34-2)25(35-3)15-21(20)17-30/h6-9,14-15,18H,4-5,10-13,16-17H2,1-3H3,(H,27,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016291 (CHEMBL3262788) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(ccc3OCC#C)C#N)Cc2cc1OC Show InChI InChI=1S/C26H29N3O4/c1-4-13-33-23-8-7-19(17-27)14-22(23)26(30)28-10-5-6-11-29-12-9-20-15-24(31-2)25(32-3)16-21(20)18-29/h1,7-8,14-16H,5-6,9-13,18H2,2-3H3,(H,28,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.68E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016273 (CHEMBL3262524) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(Cc4ccccc4)nn3)Cc2cc1OC Show InChI InChI=1S/C25H31N5O3/c1-32-23-14-20-10-13-29(17-21(20)15-24(23)33-2)12-7-6-11-26-25(31)22-18-30(28-27-22)16-19-8-4-3-5-9-19/h3-5,8-9,14-15,18H,6-7,10-13,16-17H2,1-2H3,(H,26,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016294 (CHEMBL3262791) Show SMILES COc1ccc(cc1C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1)-n1cc(nn1)-c1cncn1C Show InChI InChI=1S/C29H35N7O4/c1-34-19-30-16-25(34)24-18-36(33-32-24)22-7-8-26(38-2)23(15-22)29(37)31-10-5-6-11-35-12-9-20-13-27(39-3)28(40-4)14-21(20)17-35/h7-8,13-16,18-19H,5-6,9-12,17H2,1-4H3,(H,31,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	6.36E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50016261 (CHEMBL3262794) Show SMILES [H][C@@]12C[C@](CCN1C)(CC\C2=C\c1ccc(Cl)c(Cl)c1)c1cccc(O)c1 |r| Show InChI InChI=1S/C22H23Cl2NO/c1-25-10-9-22(17-3-2-4-18(26)13-17)8-7-16(21(25)14-22)11-15-5-6-19(23)20(24)12-15/h2-6,11-13,21,26H,7-10,14H2,1H3/b16-11-/t21?,22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.46E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to sigma-1 receptor (unknown origin)				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016274 (CHEMBL3262525) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(Cc4cccc(O)c4)nn3)Cc2cc1OC Show InChI InChI=1S/C25H31N5O4/c1-33-23-13-19-8-11-29(16-20(19)14-24(23)34-2)10-4-3-9-26-25(32)22-17-30(28-27-22)15-18-6-5-7-21(31)12-18/h5-7,12-14,17,31H,3-4,8-11,15-16H2,1-2H3,(H,26,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.08E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016287 (CHEMBL3262784) Show SMILES COc1ccccc1Cn1cc(nn1)-c1ccc(cc1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C32H37N5O4/c1-39-29-9-5-4-8-26(29)21-37-22-28(34-35-37)23-10-12-24(13-11-23)32(38)33-15-6-7-16-36-17-14-25-18-30(40-2)31(41-3)19-27(25)20-36/h4-5,8-13,18-19,22H,6-7,14-17,20-21H2,1-3H3,(H,33,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016269 (CHEMBL3262520) Show SMILES COc1cc2CCN(CCCCNC(=O)c3c[nH]nn3)Cc2cc1OC Show InChI InChI=1S/C18H25N5O3/c1-25-16-9-13-5-8-23(12-14(13)10-17(16)26-2)7-4-3-6-19-18(24)15-11-20-22-21-15/h9-11H,3-8,12H2,1-2H3,(H,19,24)(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016288 (CHEMBL3262785) Show SMILES COc1cccc(Cn2cc(nn2)-c2ccc(cc2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)c1 Show InChI InChI=1S/C32H37N5O4/c1-39-28-8-6-7-23(17-28)20-37-22-29(34-35-37)24-9-11-25(12-10-24)32(38)33-14-4-5-15-36-16-13-26-18-30(40-2)31(41-3)19-27(26)21-36/h6-12,17-19,22H,4-5,13-16,20-21H2,1-3H3,(H,33,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016295 (CHEMBL3262792) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(ccc3OC)-n3cc(COCCOCCF)nn3)Cc2cc1OC Show InChI InChI=1S/C30H40FN5O6/c1-38-27-7-6-25(36-20-24(33-34-36)21-42-15-14-41-13-9-31)18-26(27)30(37)32-10-4-5-11-35-12-8-22-16-28(39-2)29(40-3)17-23(22)19-35/h6-7,16-18,20H,4-5,8-15,19,21H2,1-3H3,(H,32,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016289 (CHEMBL3262786) Show SMILES COc1ccc(Cn2cc(nn2)-c2ccc(cc2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)cc1 Show InChI InChI=1S/C32H37N5O4/c1-39-28-12-6-23(7-13-28)20-37-22-29(34-35-37)24-8-10-25(11-9-24)32(38)33-15-4-5-16-36-17-14-26-18-30(40-2)31(41-3)19-27(26)21-36/h6-13,18-19,22H,4-5,14-17,20-21H2,1-3H3,(H,33,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016271 (CHEMBL3262522) Show SMILES COc1cccc(Cn2cc(nn2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)c1 Show InChI InChI=1S/C26H33N5O4/c1-33-22-8-6-7-19(13-22)16-31-18-23(28-29-31)26(32)27-10-4-5-11-30-12-9-20-14-24(34-2)25(35-3)15-21(20)17-30/h6-8,13-15,18H,4-5,9-12,16-17H2,1-3H3,(H,27,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.27E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016266 (CHEMBL3262517) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(nn3)-c3ccccc3OC)Cc2cc1OC Show InChI InChI=1S/C25H31N5O4/c1-32-22-9-5-4-8-21(22)30-17-20(27-28-30)25(31)26-11-6-7-12-29-13-10-18-14-23(33-2)24(34-3)15-19(18)16-29/h4-5,8-9,14-15,17H,6-7,10-13,16H2,1-3H3,(H,26,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.31E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016292 (CHEMBL3262789) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(ccc3OCc3cn(CCF)nn3)C#N)Cc2cc1OC Show InChI InChI=1S/C28H33FN6O4/c1-37-26-14-21-7-11-34(17-22(21)15-27(26)38-2)10-4-3-9-31-28(36)24-13-20(16-30)5-6-25(24)39-19-23-18-35(12-8-29)33-32-23/h5-6,13-15,18H,3-4,7-12,17,19H2,1-2H3,(H,31,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016285 (CHEMBL3262535) Show SMILES COc1cc2CCN(CCCCNC(=O)c3ccc(cc3)-c3cn(CCOCCF)nn3)Cc2cc1OC Show InChI InChI=1S/C28H36FN5O4/c1-36-26-17-23-9-13-33(19-24(23)18-27(26)37-2)12-4-3-11-30-28(35)22-7-5-21(6-8-22)25-20-34(32-31-25)14-16-38-15-10-29/h5-8,17-18,20H,3-4,9-16,19H2,1-2H3,(H,30,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.47E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016278 (CHEMBL3262529) Show SMILES COc1ccccc1-n1cc(nn1)C(=O)NCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C23H27N5O4/c1-30-20-7-5-4-6-19(20)28-15-18(25-26-28)23(29)24-9-11-27-10-8-16-12-21(31-2)22(32-3)13-17(16)14-27/h4-7,12-13,15H,8-11,14H2,1-3H3,(H,24,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.55E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016286 (CHEMBL3262536) Show SMILES COc1cc2CCN(CCCCNC(=O)c3ccc(cc3)-c3cn(CCOCCOCCF)nn3)Cc2cc1OC Show InChI InChI=1S/C30H40FN5O5/c1-38-28-19-25-9-13-35(21-26(25)20-29(28)39-2)12-4-3-11-32-30(37)24-7-5-23(6-8-24)27-22-36(34-33-27)14-16-41-18-17-40-15-10-31/h5-8,19-20,22H,3-4,9-18,21H2,1-2H3,(H,32,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016263 (CHEMBL3262514) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(nn3)-c3ccccc3OCCF)Cc2cc1OC Show InChI InChI=1S/C26H32FN5O4/c1-34-24-15-19-9-13-31(17-20(19)16-25(24)35-2)12-6-5-11-28-26(33)21-18-32(30-29-21)22-7-3-4-8-23(22)36-14-10-27/h3-4,7-8,15-16,18H,5-6,9-14,17H2,1-2H3,(H,28,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.71E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016264 (CHEMBL3262515) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(nn3)-c3cccc(OCCF)c3)Cc2cc1OC Show InChI InChI=1S/C26H32FN5O4/c1-34-24-14-19-8-12-31(17-20(19)15-25(24)35-2)11-4-3-10-28-26(33)23-18-32(30-29-23)21-6-5-7-22(16-21)36-13-9-27/h5-7,14-16,18H,3-4,8-13,17H2,1-2H3,(H,28,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.79E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016281 (CHEMBL3262531) Show SMILES COc1ccccc1Cn1cc(nn1)C(=O)NCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C24H29N5O4/c1-31-21-7-5-4-6-18(21)15-29-16-20(26-27-29)24(30)25-9-11-28-10-8-17-12-22(32-2)23(33-3)13-19(17)14-28/h4-7,12-13,16H,8-11,14-15H2,1-3H3,(H,25,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016267 (CHEMBL3262518) Show SMILES COc1cccc(c1)-n1cc(nn1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C25H31N5O4/c1-32-21-8-6-7-20(15-21)30-17-22(27-28-30)25(31)26-10-4-5-11-29-12-9-18-13-23(33-2)24(34-3)14-19(18)16-29/h6-8,13-15,17H,4-5,9-12,16H2,1-3H3,(H,26,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.02E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016270 (CHEMBL3262521) Show SMILES COc1ccccc1Cn1cc(nn1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C26H33N5O4/c1-33-23-9-5-4-8-20(23)17-31-18-22(28-29-31)26(32)27-11-6-7-12-30-13-10-19-14-24(34-2)25(35-3)15-21(19)16-30/h4-5,8-9,14-15,18H,6-7,10-13,16-17H2,1-3H3,(H,27,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.06E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016277 (CHEMBL3262528) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(Cc4ccc(OCCF)cc4)nn3)Cc2cc1OC Show InChI InChI=1S/C27H34FN5O4/c1-35-25-15-21-9-13-32(18-22(21)16-26(25)36-2)12-4-3-11-29-27(34)24-19-33(31-30-24)17-20-5-7-23(8-6-20)37-14-10-28/h5-8,15-16,19H,3-4,9-14,17-18H2,1-2H3,(H,29,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.15E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016296 (CHEMBL3262793) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(ccc3OCCF)-n3cc(CN(C)C)nn3)Cc2cc1OC Show InChI InChI=1S/C29H39FN6O4/c1-34(2)19-23-20-36(33-32-23)24-7-8-26(40-14-10-30)25(17-24)29(37)31-11-5-6-12-35-13-9-21-15-27(38-3)28(39-4)16-22(21)18-35/h7-8,15-17,20H,5-6,9-14,18-19H2,1-4H3,(H,31,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.19E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016293 (CHEMBL3262790) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cc(ccc3OC)-n3cc(CN(C)C)nn3)Cc2cc1OC Show InChI InChI=1S/C28H38N6O4/c1-32(2)18-22-19-34(31-30-22)23-8-9-25(36-3)24(16-23)28(35)29-11-6-7-12-33-13-10-20-14-26(37-4)27(38-5)15-21(20)17-33/h8-9,14-16,19H,6-7,10-13,17-18H2,1-5H3,(H,29,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016268 (CHEMBL3262519) Show SMILES COc1ccc(cc1)-n1cc(nn1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C25H31N5O4/c1-32-21-8-6-20(7-9-21)30-17-22(27-28-30)25(31)26-11-4-5-12-29-13-10-18-14-23(33-2)24(34-3)15-19(18)16-29/h6-9,14-15,17H,4-5,10-13,16H2,1-3H3,(H,26,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.92E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016276 (CHEMBL3262527) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(Cc4cccc(OCCF)c4)nn3)Cc2cc1OC Show InChI InChI=1S/C27H34FN5O4/c1-35-25-15-21-8-12-32(18-22(21)16-26(25)36-2)11-4-3-10-29-27(34)24-19-33(31-30-24)17-20-6-5-7-23(14-20)37-13-9-28/h5-7,14-16,19H,3-4,8-13,17-18H2,1-2H3,(H,29,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.63E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016265 (CHEMBL3262516) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(nn3)-c3ccc(OCCF)cc3)Cc2cc1OC Show InChI InChI=1S/C26H32FN5O4/c1-34-24-15-19-9-13-31(17-20(19)16-25(24)35-2)12-4-3-11-28-26(33)23-18-32(30-29-23)21-5-7-22(8-6-21)36-14-10-27/h5-8,15-16,18H,3-4,9-14,17H2,1-2H3,(H,28,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.63E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016275 (CHEMBL3262526) Show SMILES COc1cc2CCN(CCCCNC(=O)c3cn(Cc4ccc(O)cc4)nn3)Cc2cc1OC Show InChI InChI=1S/C25H31N5O4/c1-33-23-13-19-9-12-29(16-20(19)14-24(23)34-2)11-4-3-10-26-25(32)22-17-30(28-27-22)15-18-5-7-21(31)8-6-18/h5-8,13-14,17,31H,3-4,9-12,15-16H2,1-2H3,(H,26,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.35E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016284 (CHEMBL3262534) Show SMILES COc1cc2CCN(CCCCNC(=O)c3ccc(cc3)-c3cn(CCF)nn3)Cc2cc1OC Show InChI InChI=1S/C26H32FN5O3/c1-34-24-15-21-9-13-31(17-22(21)16-25(24)35-2)12-4-3-11-28-26(33)20-7-5-19(6-8-20)23-18-32(14-10-27)30-29-23/h5-8,15-16,18H,3-4,9-14,17H2,1-2H3,(H,28,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.19E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016279 (CHEMBL3262530) Show SMILES COc1cccc(c1)-n1cc(nn1)C(=O)NCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C23H27N5O4/c1-30-19-6-4-5-18(13-19)28-15-20(25-26-28)23(29)24-8-10-27-9-7-16-11-21(31-2)22(32-3)12-17(16)14-27/h4-6,11-13,15H,7-10,14H2,1-3H3,(H,24,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.67E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016282 (CHEMBL3262532) Show SMILES COc1cccc(Cn2cc(nn2)C(=O)NCCN2CCc3cc(OC)c(OC)cc3C2)c1 Show InChI InChI=1S/C24H29N5O4/c1-31-20-6-4-5-17(11-20)14-29-16-21(26-27-29)24(30)25-8-10-28-9-7-18-12-22(32-2)23(33-3)13-19(18)15-28/h4-6,11-13,16H,7-10,14-15H2,1-3H3,(H,25,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.01E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016283 (CHEMBL3262533) Show SMILES COc1ccc(Cn2cc(nn2)C(=O)NCCN2CCc3cc(OC)c(OC)cc3C2)cc1 Show InChI InChI=1S/C24H29N5O4/c1-31-20-6-4-17(5-7-20)14-29-16-21(26-27-29)24(30)25-9-11-28-10-8-18-12-22(32-2)23(33-3)13-19(18)15-28/h4-7,12-13,16H,8-11,14-15H2,1-3H3,(H,25,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.45E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50016280 (CHEMBL3259847) Show SMILES COc1ccc(cc1)-n1cc(nn1)C(=O)NCCN1CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C23H27N5O4/c1-30-19-6-4-18(5-7-19)28-15-20(25-26-28)23(29)24-9-11-27-10-8-16-12-21(31-2)22(32-3)13-17(16)14-27/h4-7,12-13,15H,8-11,14H2,1-3H3,(H,24,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...				J Med Chem 57: 4239-51 (2014) Article DOI: 10.1021/jm5001453 BindingDB Entry DOI: 10.7270/Q20P11KX
					More data for this Ligand-Target Pair