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SMILES: CC(C)C(=O)N1CCN(CC1)c1ccc2ncn(CC(=O)N(C)Cc3ccc(Cl)c(Cl)c3)c(=O)c2c1

InChI Key: InChIKey=UQXLNYAAHQWOJS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 450460   
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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))		BDBM450460
PNG
(9H-Fluoren-9-ylmethyl 4-[3-[2- [(3,4-dichloropheny...)
Show SMILES CC(C)C(=O)N1CCN(CC1)c1ccc2ncn(CC(=O)N(C)Cc3ccc(Cl)c(Cl)c3)c(=O)c2c1
Show InChI InChI=1S/C26H29Cl2N5O3/c1-17(2)25(35)32-10-8-31(9-11-32)19-5-7-23-20(13-19)26(36)33(16-29-23)15-24(34)30(3)14-18-4-6-21(27)22(28)12-18/h4-7,12-13,16-17H,8-11,14-15H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
ATX inhibition was measured by a fluorescence quenching assay using a specifically labeled substrate analogue (MR121 substrate). To obtain this MR121...

US Patent US10676446 (2020)


BindingDB Entry DOI: 10.7270/Q2445QJ0
More data for this
Ligand-Target Pair