BDBM50186668 (+/-)-7-(N-4-chlorophenylaminosulfonyl)-3-difluoromethyl-1,2,3,4-tetrahydroisoquinoline::CHEMBL207516

SMILES: FC(F)C1Cc2ccc(cc2CN1)S(=O)(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=FYRVUPFMMDBYMU-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50186668   

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
Phenylethanolamine N-methyltransferase (Homo sapiens (Human))	BDBM50186668 ((+/-)-7-(N-4-chlorophenylaminosulfonyl)-3-difluoro...) Show SMILES FC(F)C1Cc2ccc(cc2CN1)S(=O)(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C16H15ClF2N2O2S/c17-12-2-4-13(5-3-12)21-24(22,23)14-6-1-10-8-15(16(18)19)20-9-11(10)7-14/h1-7,15-16,20-21H,8-9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Binding affinity to human PNMT				J Med Chem 49: 2939-52 (2006) Article DOI: 10.1021/jm051262k BindingDB Entry DOI: 10.7270/Q2K64HQ3
					More data for this Ligand-Target Pair				3D Structure (docked)