BDBM50319832 1-(2-(2-(cyclopropylmethoxy)phenyl)-1-phenylethyl)piperazine::CHEMBL1083706

SMILES: C(Oc1ccccc1CC(N1CCNCC1)c1ccccc1)C1CC1

InChI Key: InChIKey=AQGRUVIDIWOMIH-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 = 50319832   

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 serotonin transporter (Homo sapiens (Human))	BDBM50319832 (1-(2-(2-(cyclopropylmethoxy)phenyl)-1-phenylethyl)...) Show SMILES C(Oc1ccccc1CC(N1CCNCC1)c1ccccc1)C1CC1 Show InChI InChI=1S/C22H28N2O/c1-2-6-19(7-3-1)21(24-14-12-23-13-15-24)16-20-8-4-5-9-22(20)25-17-18-10-11-18/h1-9,18,21,23H,10-17H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from human SERT expressed in HEK293 cells by scintillation proximity assay				Bioorg Med Chem Lett 20: 3788-92 (2010) Article DOI: 10.1016/j.bmcl.2010.04.052 BindingDB Entry DOI: 10.7270/Q2SN09X4
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50319832 (1-(2-(2-(cyclopropylmethoxy)phenyl)-1-phenylethyl)...) Show SMILES C(Oc1ccccc1CC(N1CCNCC1)c1ccccc1)C1CC1 Show InChI InChI=1S/C22H28N2O/c1-2-6-19(7-3-1)21(24-14-12-23-13-15-24)16-20-8-4-5-9-22(20)25-17-18-10-11-18/h1-9,18,21,23H,10-17H2	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]nisoxetine from human NET expressed in HEK293 cells by scintillation proximity assay				Bioorg Med Chem Lett 20: 3788-92 (2010) Article DOI: 10.1016/j.bmcl.2010.04.052 BindingDB Entry DOI: 10.7270/Q2SN09X4
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50319832 (1-(2-(2-(cyclopropylmethoxy)phenyl)-1-phenylethyl)...) Show SMILES C(Oc1ccccc1CC(N1CCNCC1)c1ccccc1)C1CC1 Show InChI InChI=1S/C22H28N2O/c1-2-6-19(7-3-1)21(24-14-12-23-13-15-24)16-20-8-4-5-9-22(20)25-17-18-10-11-18/h1-9,18,21,23H,10-17H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]dopamine from human DAT expressed in HEK293 cells by scintillation proximity assay				Bioorg Med Chem Lett 20: 3788-92 (2010) Article DOI: 10.1016/j.bmcl.2010.04.052 BindingDB Entry DOI: 10.7270/Q2SN09X4
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50319832 (1-(2-(2-(cyclopropylmethoxy)phenyl)-1-phenylethyl)...) Show SMILES C(Oc1ccccc1CC(N1CCNCC1)c1ccccc1)C1CC1 Show InChI InChI=1S/C22H28N2O/c1-2-6-19(7-3-1)21(24-14-12-23-13-15-24)16-20-8-4-5-9-22(20)25-17-18-10-11-18/h1-9,18,21,23H,10-17H2	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	2.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]dofetilide from human ERG				Bioorg Med Chem Lett 20: 3788-92 (2010) Article DOI: 10.1016/j.bmcl.2010.04.052 BindingDB Entry DOI: 10.7270/Q2SN09X4
					More data for this Ligand-Target Pair