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BDBM50143730 (2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihydroxy-piperidine-2-carboxylic acid hydroxyamide::CHEMBL60536

SMILES: ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=YFXAPTTTXDTWSV-QBPKDAKJSA-N

Data: 4 KI  1 IC50

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 5 hits for monomerid = 50143730   
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))
BDBM50143730
PNG
((2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihyd...)
Show SMILES ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H20N2O7S/c21-14-10-20(15(18(24)19-25)17(23)16(14)22)28(26,27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,21-23,25H,10H2,(H,19,24)/t14-,15-,16-,17-/m1/s1
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21n/an/an/an/an/an/an/an/a



Hokkaido Collaboration Center N-21

Curated by ChEMBL


Assay Description
Inhibition of human tumor necrosis factor alpha converting enzyme


J Med Chem 47: 1930-8 (2004)


Article DOI: 10.1021/jm0304313
BindingDB Entry DOI: 10.7270/Q2ZS2VXF
More data for this
Ligand-Target Pair
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50143730
PNG
((2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihyd...)
Show SMILES ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H20N2O7S/c21-14-10-20(15(18(24)19-25)17(23)16(14)22)28(26,27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,21-23,25H,10H2,(H,19,24)/t14-,15-,16-,17-/m1/s1
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47n/an/an/an/an/an/an/an/a



Hokkaido Collaboration Center N-21

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matrix metalloprotease 9


J Med Chem 47: 1930-8 (2004)


Article DOI: 10.1021/jm0304313
BindingDB Entry DOI: 10.7270/Q2ZS2VXF
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM50143730
PNG
((2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihyd...)
Show SMILES ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H20N2O7S/c21-14-10-20(15(18(24)19-25)17(23)16(14)22)28(26,27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,21-23,25H,10H2,(H,19,24)/t14-,15-,16-,17-/m1/s1
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50n/an/an/an/an/an/an/an/a



Hokkaido Collaboration Center N-21

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matrix metalloprotease 3


J Med Chem 47: 1930-8 (2004)


Article DOI: 10.1021/jm0304313
BindingDB Entry DOI: 10.7270/Q2ZS2VXF
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50143730
PNG
((2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihyd...)
Show SMILES ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H20N2O7S/c21-14-10-20(15(18(24)19-25)17(23)16(14)22)28(26,27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,21-23,25H,10H2,(H,19,24)/t14-,15-,16-,17-/m1/s1
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162n/an/an/an/an/an/an/an/a



Hokkaido Collaboration Center N-21

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matrix metalloprotease 1


J Med Chem 47: 1930-8 (2004)


Article DOI: 10.1021/jm0304313
BindingDB Entry DOI: 10.7270/Q2ZS2VXF
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM50143730
PNG
((2R,3R,4R,5R)-1-(Biphenyl-4-sulfonyl)-3,4,5-trihyd...)
Show SMILES ONC(=O)[C@H]1[C@@H](O)[C@H](O)[C@H](O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H20N2O7S/c21-14-10-20(15(18(24)19-25)17(23)16(14)22)28(26,27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,21-23,25H,10H2,(H,19,24)/t14-,15-,16-,17-/m1/s1
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n/an/a 2.10E+4n/an/an/an/an/an/a



Hokkaido Collaboration Center N-21

Curated by ChEMBL


Assay Description
Inhibition of heparin-binding HB-EGF shedding


J Med Chem 47: 1930-8 (2004)


Article DOI: 10.1021/jm0304313
BindingDB Entry DOI: 10.7270/Q2ZS2VXF
More data for this
Ligand-Target Pair