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BDBM50355463 CHEMBL1835560

SMILES: ONC(=O)[C@H]1CCC[C@H]1NC(=O)c1ccc(Cn2c(nc3ccccc23)C(F)(F)F)nc1

InChI Key: InChIKey=AHNMTSUUYUMNIJ-LSDHHAIUSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50355463   
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))
BDBM50355463
PNG
(CHEMBL1835560)
Show SMILES ONC(=O)[C@H]1CCC[C@H]1NC(=O)c1ccc(Cn2c(nc3ccccc23)C(F)(F)F)nc1
Show InChI InChI=1S/C21H20F3N5O3/c22-21(23,24)20-27-16-5-1-2-7-17(16)29(20)11-13-9-8-12(10-25-13)18(30)26-15-6-3-4-14(15)19(31)28-32/h1-2,5,7-10,14-15,32H,3-4,6,11H2,(H,26,30)(H,28,31)/t14-,15+/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 74n/an/an/an/an/an/a



Sun Pharma Advanced Research Company Ltd

Curated by ChEMBL


Assay Description
Inhibition of TACE in human whole blood assessed as reduction of of LPS-induced TNFalpha production pretreated 15 mins before LPS challenge measured ...


Eur J Med Chem 46: 5549-55 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.018
BindingDB Entry DOI: 10.7270/Q2JQ11FF
More data for this
Ligand-Target Pair