BDBM50300537 (1S,2R)-1-(2-chlorophenyl)-1-(1H-indol-1-yl)-3-(methylamino)propan-2-ol::CHEMBL583113

SMILES: CNC[C@@H](O)[C@H](c1ccccc1Cl)n1ccc2ccccc12

InChI Key: InChIKey=DGZJTKQIMNNTQO-MSOLQXFVSA-N

Data: 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 2 hits for monomerid = 50300537   

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))	BDBM50300537 ((1S,2R)-1-(2-chlorophenyl)-1-(1H-indol-1-yl)-3-(me...) Show SMILES CNC[C@@H](O)[C@H](c1ccccc1Cl)n1ccc2ccccc12 |r| Show InChI InChI=1S/C18H19ClN2O/c1-20-12-17(22)18(14-7-3-4-8-15(14)19)21-11-10-13-6-2-5-9-16(13)21/h2-11,17-18,20,22H,12H2,1H3/t17-,18+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	304	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human NET expressed in MDCK-Net6 cells				Bioorg Med Chem Lett 19: 5807-10 (2009) Article DOI: 10.1016/j.bmcl.2009.07.050 BindingDB Entry DOI: 10.7270/Q2H70FV8
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50300537 ((1S,2R)-1-(2-chlorophenyl)-1-(1H-indol-1-yl)-3-(me...) Show SMILES CNC[C@@H](O)[C@H](c1ccccc1Cl)n1ccc2ccccc12 |r| Show InChI InChI=1S/C18H19ClN2O/c1-20-12-17(22)18(14-7-3-4-8-15(14)19)21-11-10-13-6-2-5-9-16(13)21/h2-11,17-18,20,22H,12H2,1H3/t17-,18+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human SERT expressed in JAR cells				Bioorg Med Chem Lett 19: 5807-10 (2009) Article DOI: 10.1016/j.bmcl.2009.07.050 BindingDB Entry DOI: 10.7270/Q2H70FV8
					More data for this Ligand-Target Pair