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BDBM50309152 (2R,3R)-N-benzyl-4-(2-(3-chlorophenyl)pyrrolidin-1-yl)-2,3-dihydroxy-4-oxobutanamide::CHEMBL606458

SMILES: O[C@H]([C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)C(=O)NCc1ccccc1

InChI Key: InChIKey=UPSOWFNLCOSXGA-OMKBGSMGSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50309152   
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))
BDBM50309152
PNG
((2R,3R)-N-benzyl-4-(2-(3-chlorophenyl)pyrrolidin-1...)
Show SMILES O[C@H]([C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)C(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C21H23ClN2O4/c22-16-9-4-8-15(12-16)17-10-5-11-24(17)21(28)19(26)18(25)20(27)23-13-14-6-2-1-3-7-14/h1-4,6-9,12,17-19,25-26H,5,10-11,13H2,(H,23,27)/t17?,18-,19-/m1/s1
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Similars

Article
PubMed
1.44E+3n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute Cambridge

Curated by ChEMBL


Assay Description
Inhibition of TACE


Bioorg Med Chem Lett 20: 1189-93 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.004
BindingDB Entry DOI: 10.7270/Q2BK1CFB
More data for this
Ligand-Target Pair