BDBM50375707 CHEMBL436673

SMILES: CCc1ccccc1Oc1cc(C)ncc1CN(C)C

InChI Key: InChIKey=GAWWNBHCOINKBY-UHFFFAOYSA-N

Data: 3 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50375707   

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
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50375707 (CHEMBL436673) Show SMILES CCc1ccccc1Oc1cc(C)ncc1CN(C)C Show InChI InChI=1S/C17H22N2O/c1-5-14-8-6-7-9-16(14)20-17-10-13(2)18-11-15(17)12-19(3)4/h6-11H,5,12H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]Nisoxetine uptake in human noradrenaline transporter transfected HEK293 cells				Bioorg Med Chem Lett 18: 1795-8 (2008) Article DOI: 10.1016/j.bmcl.2008.02.036 BindingDB Entry DOI: 10.7270/Q2125TH5
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50375707 (CHEMBL436673) Show SMILES CCc1ccccc1Oc1cc(C)ncc1CN(C)C Show InChI InChI=1S/C17H22N2O/c1-5-14-8-6-7-9-16(14)20-17-10-13(2)18-11-15(17)12-19(3)4/h6-11H,5,12H2,1-4H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	279	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]Citalopram uptake in human 5HTT transfected HEK293 cells				Bioorg Med Chem Lett 18: 1795-8 (2008) Article DOI: 10.1016/j.bmcl.2008.02.036 BindingDB Entry DOI: 10.7270/Q2125TH5
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50375707 (CHEMBL436673) Show SMILES CCc1ccccc1Oc1cc(C)ncc1CN(C)C Show InChI InChI=1S/C17H22N2O/c1-5-14-8-6-7-9-16(14)20-17-10-13(2)18-11-15(17)12-19(3)4/h6-11H,5,12H2,1-4H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN-35428 uptake in human DAT transfected HEK293 cells				Bioorg Med Chem Lett 18: 1795-8 (2008) Article DOI: 10.1016/j.bmcl.2008.02.036 BindingDB Entry DOI: 10.7270/Q2125TH5
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50375707 (CHEMBL436673) Show SMILES CCc1ccccc1Oc1cc(C)ncc1CN(C)C Show InChI InChI=1S/C17H22N2O/c1-5-14-8-6-7-9-16(14)20-17-10-13(2)18-11-15(17)12-19(3)4/h6-11H,5,12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]dofetilide from human ERG channel				Bioorg Med Chem Lett 18: 1795-8 (2008) Article DOI: 10.1016/j.bmcl.2008.02.036 BindingDB Entry DOI: 10.7270/Q2125TH5
					More data for this Ligand-Target Pair