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BDBM50309146 (2R,3R)-4-(2-(2-chlorophenyl)pyrrolidin-1-yl)-2,3-dihydroxy-4-oxo-N-(2-(thiophen-2-yl)ethyl)butanamide::CHEMBL590342

SMILES: O[C@H]([C@@H](O)C(=O)N1CCCC1c1ccccc1Cl)C(=O)NCCc1cccs1

InChI Key: InChIKey=PPCRCDGKHOSSFZ-UKKPGEIXSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50309146   
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))
BDBM50309146
PNG
((2R,3R)-4-(2-(2-chlorophenyl)pyrrolidin-1-yl)-2,3-...)
Show SMILES O[C@H]([C@@H](O)C(=O)N1CCCC1c1ccccc1Cl)C(=O)NCCc1cccs1 |r|
Show InChI InChI=1S/C20H23ClN2O4S/c21-15-7-2-1-6-14(15)16-8-3-11-23(16)20(27)18(25)17(24)19(26)22-10-9-13-5-4-12-28-13/h1-2,4-7,12,16-18,24-25H,3,8-11H2,(H,22,26)/t16?,17-,18-/m1/s1
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Similars

Article
PubMed
323n/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