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BDBM50227713 2-[4-(2-ethyl-biphenyl-4-yl)-3,6-dihydro-2H-pyridine-1-sulfonyl]-N-hydroxy-acetamide::CHEMBL398639

SMILES: CCc1cc(ccc1-c1ccccc1)C1=CCN(CC1)S(=O)(=O)CC(=O)NO

InChI Key: InChIKey=XRBRLEUPIULYDY-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50227713   
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
Stromelysin-1


(Homo sapiens (Human))
BDBM50227713
PNG
(2-[4-(2-ethyl-biphenyl-4-yl)-3,6-dihydro-2H-pyridi...)
Show SMILES CCc1cc(ccc1-c1ccccc1)C1=CCN(CC1)S(=O)(=O)CC(=O)NO |t:16|
Show InChI InChI=1S/C21H24N2O4S/c1-2-16-14-19(8-9-20(16)18-6-4-3-5-7-18)17-10-12-23(13-11-17)28(26,27)15-21(24)22-25/h3-10,14,25H,2,11-13,15H2,1H3,(H,22,24)
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MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 420n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MMP3


Bioorg Med Chem Lett 17: 6750-3 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.042
BindingDB Entry DOI: 10.7270/Q20K289K
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50227713
PNG
(2-[4-(2-ethyl-biphenyl-4-yl)-3,6-dihydro-2H-pyridi...)
Show SMILES CCc1cc(ccc1-c1ccccc1)C1=CCN(CC1)S(=O)(=O)CC(=O)NO |t:16|
Show InChI InChI=1S/C21H24N2O4S/c1-2-16-14-19(8-9-20(16)18-6-4-3-5-7-18)17-10-12-23(13-11-17)28(26,27)15-21(24)22-25/h3-10,14,25H,2,11-13,15H2,1H3,(H,22,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.38E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MMP2


Bioorg Med Chem Lett 17: 6750-3 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.042
BindingDB Entry DOI: 10.7270/Q20K289K
More data for this
Ligand-Target Pair