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BDBM50441225 CHEMBL2431032

SMILES: ONC(=O)CNS(=O)(=O)c1ccc(OCc2ccc(cc2)-c2ccccc2)cc1

InChI Key: InChIKey=LGTBURVEOHTXLS-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50441225   
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))
BDBM50441225
PNG
(CHEMBL2431032)
Show SMILES ONC(=O)CNS(=O)(=O)c1ccc(OCc2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C21H20N2O5S/c24-21(23-25)14-22-29(26,27)20-12-10-19(11-13-20)28-15-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-13,22,25H,14-15H2,(H,23,24)
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 640n/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ADAM-17 using Mca-Lys-Pro-Leu-Gly-Leu-Dap(Dnp)-Ala-Arg-NH2 as substrate incubated for 30 mins measured every 15 secs ...


J Med Chem 56: 8089-103 (2013)


Article DOI: 10.1021/jm4011753
BindingDB Entry DOI: 10.7270/Q2DR2WZ0
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50441225
PNG
(CHEMBL2431032)
Show SMILES ONC(=O)CNS(=O)(=O)c1ccc(OCc2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C21H20N2O5S/c24-21(23-25)14-22-29(26,27)20-12-10-19(11-13-20)28-15-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-13,22,25H,14-15H2,(H,23,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.20E+4n/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MMP-14 catalytic domain using Mca-Lys-Pro-Leu-Gly-Leu-Dap(Dnp)-Ala-Arg-NH2 as substrate incubated for 4 hrs measured ...


J Med Chem 56: 8089-103 (2013)


Article DOI: 10.1021/jm4011753
BindingDB Entry DOI: 10.7270/Q2DR2WZ0
More data for this
Ligand-Target Pair