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BDBM50105427 2-Acetylamino-N-hydroxy-3-(4-phenoxy-benzenesulfonyl)-propionamide::CHEMBL91668

SMILES: CC(=O)NC(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO

InChI Key: InChIKey=ZNJTZTNWABBABD-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50105427   
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
Interstitial collagenase


(Homo sapiens (Human))
BDBM50105427
PNG
(2-Acetylamino-N-hydroxy-3-(4-phenoxy-benzenesulfon...)
Show SMILES CC(=O)NC(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N2O6S/c1-12(20)18-16(17(21)19-22)11-26(23,24)15-9-7-14(8-10-15)25-13-5-3-2-4-6-13/h2-10,16,22H,11H2,1H3,(H,18,20)(H,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 7.70E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-1


Bioorg Med Chem Lett 11: 2719-22 (2001)


BindingDB Entry DOI: 10.7270/Q2TD9WNW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50105427
PNG
(2-Acetylamino-N-hydroxy-3-(4-phenoxy-benzenesulfon...)
Show SMILES CC(=O)NC(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N2O6S/c1-12(20)18-16(17(21)19-22)11-26(23,24)15-9-7-14(8-10-15)25-13-5-3-2-4-6-13/h2-10,16,22H,11H2,1H3,(H,18,20)(H,19,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-13


Bioorg Med Chem Lett 11: 2719-22 (2001)


BindingDB Entry DOI: 10.7270/Q2TD9WNW
More data for this
Ligand-Target Pair