Compile Data Set for Download or QSAR

Found 9 hits with Last Name = 'zhang' and Initial = 'jm'   

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
Emopamil-binding protein-like (Homo sapiens (Human))	BDBM50424041 (CHEMBL2314420) Show SMILES COc1ccc(CCN2CCN(CCCc3ccccc3)CC2)cc1OO Show InChI InChI=1S/C22H30N2O3/c1-26-21-10-9-20(18-22(21)27-25)11-13-24-16-14-23(15-17-24)12-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-10,18,25H,5,8,11-17H2,1H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Binding affinity to emopamil binding protein (unknown origin)				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50424039 (CHEMBL2314424) Show SMILES FCCOc1ccc(CN2CCN(Cc3ccc4OCOc4c3)CC2)cc1 Show InChI InChI=1S/C21H25FN2O3/c22-7-12-25-19-4-1-17(2-5-19)14-23-8-10-24(11-9-23)15-18-3-6-20-21(13-18)27-16-26-20/h1-6,13H,7-12,14-16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Emopamil-binding protein-like (Homo sapiens (Human))	BDBM20607 ((2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethy...) Show SMILES CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	2.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Binding affinity to emopamil binding protein (unknown origin)				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Emopamil-binding protein-like (Homo sapiens (Human))	BDBM79181 (10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoro...) Show SMILES CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1 Show InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	3.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Binding affinity to emopamil binding protein (unknown origin)				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair				3D Structure (crystal)
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50424038 (CHEMBL2314425) Show SMILES FCCOCCOc1ccc(CN2CCN(Cc3ccc4OCOc4c3)CC2)cc1 Show InChI InChI=1S/C23H29FN2O4/c24-7-12-27-13-14-28-21-4-1-19(2-5-21)16-25-8-10-26(11-9-25)17-20-3-6-22-23(15-20)30-18-29-22/h1-6,15H,7-14,16-18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Homo sapiens (Human))	BDBM50334158 (1'-benzyl-3-(2-fluoroethyl)-3H-spiro[[2]benzofuran...) Show SMILES FCCC1OC2(CCN(Cc3ccccc3)CC2)c2ccccc12 Show InChI InChI=1S/C21H24FNO/c22-13-10-20-18-8-4-5-9-19(18)21(24-20)11-14-23(15-12-21)16-17-6-2-1-3-7-17/h1-9,20H,10-16H2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	211	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Binding affinity to VAChT (unknown origin)				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50424037 (CHEMBL2314426) Show SMILES FCCOCCOCCOc1ccc(CN2CCN(Cc3ccc4OCOc4c3)CC2)cc1 Show InChI InChI=1S/C25H33FN2O5/c26-7-12-29-13-14-30-15-16-31-23-4-1-21(2-5-23)18-27-8-10-28(11-9-27)19-22-3-6-24-25(17-22)33-20-32-24/h1-6,17H,7-16,18-20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	505	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair
Emopamil-binding protein-like (Homo sapiens (Human))	BDBM50334158 (1'-benzyl-3-(2-fluoroethyl)-3H-spiro[[2]benzofuran...) Show SMILES FCCC1OC2(CCN(Cc3ccccc3)CC2)c2ccccc12 Show InChI InChI=1S/C21H24FNO/c22-13-10-20-18-8-4-5-9-19(18)21(24-20)11-14-23(15-12-21)16-17-6-2-1-3-7-17/h1-9,20H,10-16H2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Binding affinity to emopamil binding protein (unknown origin)				Bioorg Med Chem 21: 215-22 (2012) Article DOI: 10.1016/j.bmc.2012.10.038 BindingDB Entry DOI: 10.7270/Q2VM4DKP
					More data for this Ligand-Target Pair