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BDBM50343086 CHEMBL1771221::N-hydroxy-4-(4-(3-(4-(4-(trifluoromethoxy)phenyl)-1H-imidazol-1-yl)propoxy)phenylsulfonyl)tetrahydro-2H-pyran-4-carboxamide

SMILES: ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1

InChI Key: InChIKey=JRPLACGAMSWTCU-UHFFFAOYSA-N

Data: 8 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50343086   
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
Collagenase


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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1.70n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-13


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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59n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-3


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Matrix Metalloproteinase-8 (MMP-8)


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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74n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-8


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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530n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-2


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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1.80E+3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-9


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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6.00E+3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-7


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 (MMP14)


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-14


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(Homo sapiens (Human))
BDBM50343086
PNG
(CHEMBL1771221 | N-hydroxy-4-(4-(3-(4-(4-(trifluoro...)
Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCn2cnc(c2)-c2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H26F3N3O7S/c26-25(27,28)38-20-4-2-18(3-5-20)22-16-31(17-29-22)12-1-13-37-19-6-8-21(9-7-19)39(34,35)24(23(32)30-33)10-14-36-15-11-24/h2-9,16-17,33H,1,10-15H2,(H,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human MMP-1


Bioorg Med Chem Lett 21: 2820-2 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.099
BindingDB Entry DOI: 10.7270/Q2416XCK
More data for this
Ligand-Target Pair