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BDBM309210 (3R,4S)-N-(2,2-difluorohexyl)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]pyrrolidin-3-amine::US9656955, Example 733

SMILES: CCCCC(F)(F)CN[C@H]1CN(C[C@@H]1c1ccc(F)cc1)S(=O)(=O)c1cn(C)cn1

InChI Key: InChIKey=KKMSUWHCAMWWTH-MSOLQXFVSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 309210   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309210
PNG
((3R,4S)-N-(2,2-difluorohexyl)-4-(4-fluorophenyl)-1...)
Show SMILES CCCCC(F)(F)CN[C@H]1CN(C[C@@H]1c1ccc(F)cc1)S(=O)(=O)c1cn(C)cn1
Show InChI InChI=1S/C20H27F3N4O2S/c1-3-4-9-20(22,23)13-24-18-11-27(30(28,29)19-12-26(2)14-25-19)10-17(18)15-5-7-16(21)8-6-15/h5-8,12,14,17-18,24H,3-4,9-11,13H2,1-2H3/t17-,18+/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
<10n/an/an/an/an/an/an/an/a



AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair