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SMILES: Nc1nc2cc3CCN(Cc4cccc(F)c4)CCc3cc2s1

InChI Key: InChIKey=JGVMWDMAURDGRG-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50426663   

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(2) dopamine receptor (Homo sapiens (Human))	BDBM50426663 (CHEMBL2326478) Show SMILES Nc1nc2cc3CCN(Cc4cccc(F)c4)CCc3cc2s1 Show InChI InChI=1S/C18H18FN3S/c19-15-3-1-2-12(8-15)11-22-6-4-13-9-16-17(23-18(20)21-16)10-14(13)5-7-22/h1-3,8-10H,4-7,11H2,(H2,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [3H]raclopride from human D2 dopamine receptor expressed in CHO cell membranes				Bioorg Med Chem Lett 23: 543-7 (2012) Article DOI: 10.1016/j.bmcl.2012.11.023 BindingDB Entry DOI: 10.7270/Q2639R2X
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50426663 (CHEMBL2326478) Show SMILES Nc1nc2cc3CCN(Cc4cccc(F)c4)CCc3cc2s1 Show InChI InChI=1S/C18H18FN3S/c19-15-3-1-2-12(8-15)11-22-6-4-13-9-16-17(23-18(20)21-16)10-14(13)5-7-22/h1-3,8-10H,4-7,11H2,(H2,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Antagonist activity at human D2 dopamine receptor expressed in CHO cell membrane by GTPgammaS-binding assay				Bioorg Med Chem Lett 23: 543-7 (2012) Article DOI: 10.1016/j.bmcl.2012.11.023 BindingDB Entry DOI: 10.7270/Q2639R2X
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50426663 (CHEMBL2326478) Show SMILES Nc1nc2cc3CCN(Cc4cccc(F)c4)CCc3cc2s1 Show InChI InChI=1S/C18H18FN3S/c19-15-3-1-2-12(8-15)11-22-6-4-13-9-16-17(23-18(20)21-16)10-14(13)5-7-22/h1-3,8-10H,4-7,11H2,(H2,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human ERG				Bioorg Med Chem Lett 23: 543-7 (2012) Article DOI: 10.1016/j.bmcl.2012.11.023 BindingDB Entry DOI: 10.7270/Q2639R2X
					More data for this Ligand-Target Pair