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SMILES: CC(C)c1ccccc1NC(N)=Nc1ccccc1C(C)C

InChI Key: InChIKey=KCNBAUKGODRNGM-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50010755   

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))	BDBM50010755 (CHEMBL280243 | N,N'-Bis-(2-isopropyl-phenyl)-guani...) Show SMILES CC(C)c1ccccc1NC(N)=Nc1ccccc1C(C)C |w:12.13| Show InChI InChI=1S/C19H25N3/c1-13(2)15-9-5-7-11-17(15)21-19(20)22-18-12-8-6-10-16(18)14(3)4/h5-14H,1-4H3,(H3,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
University of Oregon Curated by ChEMBL					Assay Description In vitro inhibitory activity against [3H]DTG binding to Sigma opioid receptor in guinea pig brain membrane homogenates				J Med Chem 33: 2421-9 (1990) BindingDB Entry DOI: 10.7270/Q25Q4WQ3
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50010755 (CHEMBL280243 | N,N'-Bis-(2-isopropyl-phenyl)-guani...) Show SMILES CC(C)c1ccccc1NC(N)=Nc1ccccc1C(C)C |w:12.13| Show InChI InChI=1S/C19H25N3/c1-13(2)15-9-5-7-11-17(15)21-19(20)22-18-12-8-6-10-16(18)14(3)4/h5-14H,1-4H3,(H3,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Cambridge NeuroScience, Inc. Curated by ChEMBL					Assay Description Tested in vitro for the concentration required to inhibit specific [3H]-DTG radioligand binding to sigma receptor on guinea pig brain membrane				J Med Chem 37: 260-7 (1994) BindingDB Entry DOI: 10.7270/Q2HX1BRZ
					More data for this Ligand-Target Pair