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SMILES: CSc1c(Cl)nc(nc1NC(C)(C)C)N1CCN(C)CC1

InChI Key: InChIKey=IYCYXAHCVNMYRB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50226335   

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
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50226335 (CHEMBL284682) Show SMILES CSc1c(Cl)nc(nc1NC(C)(C)C)N1CCN(C)CC1 Show InChI InChI=1S/C14H24ClN5S/c1-14(2,3)18-12-10(21-5)11(15)16-13(17-12)20-8-6-19(4)7-9-20/h6-9H2,1-5H3,(H,16,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro binding affinity was measured as the inhibition of [3H]clonidine binding to alpha-2 adrenergic receptor of rat cortical membranes				J Med Chem 29: 1394-8 (1986) BindingDB Entry DOI: 10.7270/Q21R6SQQ
					More data for this Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50226335 (CHEMBL284682) Show SMILES CSc1c(Cl)nc(nc1NC(C)(C)C)N1CCN(C)CC1 Show InChI InChI=1S/C14H24ClN5S/c1-14(2,3)18-12-10(21-5)11(15)16-13(17-12)20-8-6-19(4)7-9-20/h6-9H2,1-5H3,(H,16,17,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro binding affinity was measured as the inhibition of [3H]WB-4101 binding to alpha-1 adrenergic receptor of rat cortical membranes				J Med Chem 29: 1394-8 (1986) BindingDB Entry DOI: 10.7270/Q21R6SQQ
					More data for this Ligand-Target Pair
D(1A)/D(1B)/D(2)/D(3)/D(4) dopamine receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50226335 (CHEMBL284682) Show SMILES CSc1c(Cl)nc(nc1NC(C)(C)C)N1CCN(C)CC1 Show InChI InChI=1S/C14H24ClN5S/c1-14(2,3)18-12-10(21-5)11(15)16-13(17-12)20-8-6-19(4)7-9-20/h6-9H2,1-5H3,(H,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	920	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro binding affinity to Dopamine receptors of rat striatal membranes by [3H]spiroperidol displacement.				J Med Chem 29: 1394-8 (1986) BindingDB Entry DOI: 10.7270/Q21R6SQQ
					More data for this Ligand-Target Pair