BDBM50459937 CHEMBL4225921

SMILES: Clc1ccc(cc1Cl)C1CCNCC11COC1

InChI Key: InChIKey=HZJCTPKBQPYEHA-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50459937   

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))	BDBM50459937 (CHEMBL4225921) Show SMILES Clc1ccc(cc1Cl)C1CCNCC11COC1 Show InChI InChI=1S/C13H15Cl2NO/c14-11-2-1-9(5-12(11)15)10-3-4-16-6-13(10)7-17-8-13/h1-2,5,10,16H,3-4,6-8H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biocon Bristol-Myers Squibb R&D Centre Curated by ChEMBL					Assay Description Binding affinity to human SERT				J Med Chem 61: 2133-2165 (2018) Article DOI: 10.1021/acs.jmedchem.6b01827 BindingDB Entry DOI: 10.7270/Q2BV7K8M
					More data for this Ligand-Target Pair
Monoamine transporter (Homo sapiens (Human))	BDBM50459937 (CHEMBL4225921) Show SMILES Clc1ccc(cc1Cl)C1CCNCC11COC1 Show InChI InChI=1S/C13H15Cl2NO/c14-11-2-1-9(5-12(11)15)10-3-4-16-6-13(10)7-17-8-13/h1-2,5,10,16H,3-4,6-8H2	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biocon Bristol-Myers Squibb R&D Centre Curated by ChEMBL					Assay Description Binding affinity to human NET				J Med Chem 61: 2133-2165 (2018) Article DOI: 10.1021/acs.jmedchem.6b01827 BindingDB Entry DOI: 10.7270/Q2BV7K8M
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50459937 (CHEMBL4225921) Show SMILES Clc1ccc(cc1Cl)C1CCNCC11COC1 Show InChI InChI=1S/C13H15Cl2NO/c14-11-2-1-9(5-12(11)15)10-3-4-16-6-13(10)7-17-8-13/h1-2,5,10,16H,3-4,6-8H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biocon Bristol-Myers Squibb R&D Centre Curated by ChEMBL					Assay Description Binding affinity to human DAT				J Med Chem 61: 2133-2165 (2018) Article DOI: 10.1021/acs.jmedchem.6b01827 BindingDB Entry DOI: 10.7270/Q2BV7K8M
					More data for this Ligand-Target Pair