BDBM50426347 CHEMBL2326684

SMILES: CN1CC=CCC(C1)c1ccc(Cl)c(C)c1

InChI Key: InChIKey=MMBDWDAKDCKUAX-UHFFFAOYSA-N

Data: 3 KI  2 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 5 hits for monomerid = 50426347   

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 dopamine transporter (Homo sapiens (Human))	BDBM50426347 (CHEMBL2326684) Show SMILES CN1CC=CCC(C1)c1ccc(Cl)c(C)c1 |c:3| Show InChI InChI=1S/C14H18ClN/c1-11-9-12(6-7-14(11)15)13-5-3-4-8-16(2)10-13/h3-4,6-7,9,13H,5,8,10H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant DAT expressed in HEK cells				ACS Med Chem Lett 4: 46-51 (2013) Article DOI: 10.1021/ml300262e BindingDB Entry DOI: 10.7270/Q2FQ9XXK
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50426347 (CHEMBL2326684) Show SMILES CN1CC=CCC(C1)c1ccc(Cl)c(C)c1 |c:3| Show InChI InChI=1S/C14H18ClN/c1-11-9-12(6-7-14(11)15)13-5-3-4-8-16(2)10-13/h3-4,6-7,9,13H,5,8,10H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant NET expressed in HEK cells				ACS Med Chem Lett 4: 46-51 (2013) Article DOI: 10.1021/ml300262e BindingDB Entry DOI: 10.7270/Q2FQ9XXK
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50426347 (CHEMBL2326684) Show SMILES CN1CC=CCC(C1)c1ccc(Cl)c(C)c1 |c:3| Show InChI InChI=1S/C14H18ClN/c1-11-9-12(6-7-14(11)15)13-5-3-4-8-16(2)10-13/h3-4,6-7,9,13H,5,8,10H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	270	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant SERT expressed in HEK cells				ACS Med Chem Lett 4: 46-51 (2013) Article DOI: 10.1021/ml300262e BindingDB Entry DOI: 10.7270/Q2FQ9XXK
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50426347 (CHEMBL2326684) Show SMILES CN1CC=CCC(C1)c1ccc(Cl)c(C)c1 |c:3| Show InChI InChI=1S/C14H18ClN/c1-11-9-12(6-7-14(11)15)13-5-3-4-8-16(2)10-13/h3-4,6-7,9,13H,5,8,10H2,1-2H3	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	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human ERG expressed in CHO-K1 cells by electrophysiological assay				ACS Med Chem Lett 4: 46-51 (2013) Article DOI: 10.1021/ml300262e BindingDB Entry DOI: 10.7270/Q2FQ9XXK
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50426347 (CHEMBL2326684) Show SMILES CN1CC=CCC(C1)c1ccc(Cl)c(C)c1 |c:3| Show InChI InChI=1S/C14H18ClN/c1-11-9-12(6-7-14(11)15)13-5-3-4-8-16(2)10-13/h3-4,6-7,9,13H,5,8,10H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of CYP2D6 (unknown origin)				ACS Med Chem Lett 4: 46-51 (2013) Article DOI: 10.1021/ml300262e BindingDB Entry DOI: 10.7270/Q2FQ9XXK
					More data for this Ligand-Target Pair