null

SMILES: O=C1N(CCN2Cc3ccccc3C2)CCN1c1csc2ccccc12

InChI Key: InChIKey=ZVQVWCQOAHBIGN-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50414419   

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
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50414419 (CHEMBL563247) Show SMILES O=C1N(CCN2Cc3ccccc3C2)CCN1c1csc2ccccc12 Show InChI InChI=1S/C21H21N3OS/c25-21-23(10-9-22-13-16-5-1-2-6-17(16)14-22)11-12-24(21)19-15-26-20-8-4-3-7-18(19)20/h1-8,15H,9-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor expressed in CHO cells by [35S]GTP-gamma-S-based scintillation spectrometry				Bioorg Med Chem Lett 19: 4011-3 (2009) Article DOI: 10.1016/j.bmcl.2009.06.028 BindingDB Entry DOI: 10.7270/Q2J67J55
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50414419 (CHEMBL563247) Show SMILES O=C1N(CCN2Cc3ccccc3C2)CCN1c1csc2ccccc12 Show InChI InChI=1S/C21H21N3OS/c25-21-23(10-9-22-13-16-5-1-2-6-17(16)14-22)11-12-24(21)19-15-26-20-8-4-3-7-18(19)20/h1-8,15H,9-14H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D2 receptor expressed in CHO cells by [35S]GTP-gamma-S-based scintillation spectrometry				Bioorg Med Chem Lett 19: 4011-3 (2009) Article DOI: 10.1016/j.bmcl.2009.06.028 BindingDB Entry DOI: 10.7270/Q2J67J55
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50414419 (CHEMBL563247) Show SMILES O=C1N(CCN2Cc3ccccc3C2)CCN1c1csc2ccccc12 Show InChI InChI=1S/C21H21N3OS/c25-21-23(10-9-22-13-16-5-1-2-6-17(16)14-22)11-12-24(21)19-15-26-20-8-4-3-7-18(19)20/h1-8,15H,9-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [3H]dofetilide from human ERG channel by scintillation proximity assay				Bioorg Med Chem Lett 19: 4011-3 (2009) Article DOI: 10.1016/j.bmcl.2009.06.028 BindingDB Entry DOI: 10.7270/Q2J67J55
					More data for this Ligand-Target Pair