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BDBM50313851 (+/-)-5-(4-fluorophenyl)-5-((5-((2-methylquinolin-4-yl)methoxy)-1-oxoisoindolin-2-yl)methyl)imidazolidine-2,4-dione::CHEMBL1084412

SMILES: Cc1cc(COc2ccc3C(=O)N(CC4(NC(=O)NC4=O)c4ccc(F)cc4)Cc3c2)c2ccccc2n1

InChI Key: InChIKey=CXUFMSGHQOMBDY-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50313851   
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
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM50313851
PNG
((+/-)-5-(4-fluorophenyl)-5-((5-((2-methylquinolin-...)
Show SMILES Cc1cc(COc2ccc3C(=O)N(CC4(NC(=O)NC4=O)c4ccc(F)cc4)Cc3c2)c2ccccc2n1
Show InChI InChI=1S/C29H23FN4O4/c1-17-12-19(23-4-2-3-5-25(23)31-17)15-38-22-10-11-24-18(13-22)14-34(26(24)35)16-29(27(36)32-28(37)33-29)20-6-8-21(30)9-7-20/h2-13H,14-16H2,1H3,(H2,32,33,36,37)
PDB
MMDB

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Similars

Article
PubMed
1.70n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of TACE by FRET assay


Bioorg Med Chem Lett 20: 1877-80 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.148
BindingDB Entry DOI: 10.7270/Q2F76CQ9
More data for this
Ligand-Target Pair