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6 similar compounds to monomer 28308

Compile data set for download or QSAR
Wt: 415.8
BDBM28306
Purchase
Wt: 429.9
BDBM28307
Wt: 469.9
BDBM28309
Wt: 512.0
BDBM28310
Wt: 506.0
BDBM28311
Wt: 520.0
BDBM28312

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 28306,28307,28309,28310,28311,28312   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28306
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene]sulfonamido}-3-...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H18ClNO4S/c22-18-10-6-16(7-11-18)17-8-12-19(13-9-17)28(26,27)23-20(21(24)25)14-15-4-2-1-3-5-15/h1-13,20,23H,14H2,(H,24,25)/t20-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.20E+3n/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28307
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](methyl)sulfona...)
Show SMILES CN([C@H](Cc1ccccc1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20ClNO4S/c1-24(21(22(25)26)15-16-5-3-2-4-6-16)29(27,28)20-13-9-18(10-14-20)17-7-11-19(23)12-8-17/h2-14,21H,15H2,1H3,(H,25,26)/t21-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.00E+3n/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28312
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](2-phenylethyl)...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CCc1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C29H26ClNO4S/c30-26-15-11-24(12-16-26)25-13-17-27(18-14-25)36(34,35)31(20-19-22-7-3-1-4-8-22)28(29(32)33)21-23-9-5-2-6-10-23/h1-18,28H,19-21H2,(H,32,33)/t28-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.30E+3n/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28310
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](cyclohexylmeth...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CC1CCCCC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H30ClNO4S/c29-25-15-11-23(12-16-25)24-13-17-26(18-14-24)35(33,34)30(20-22-9-5-2-6-10-22)27(28(31)32)19-21-7-3-1-4-8-21/h1,3-4,7-8,11-18,22,27H,2,5-6,9-10,19-20H2,(H,31,32)/t27-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28311
PNG
((2R)-2-{benzyl[4-(4-chlorophenyl)benzene]sulfonami...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H24ClNO4S/c29-25-15-11-23(12-16-25)24-13-17-26(18-14-24)35(33,34)30(20-22-9-5-2-6-10-22)27(28(31)32)19-21-7-3-1-4-8-21/h1-18,27H,19-20H2,(H,31,32)/t27-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (Human))
BDBM28309
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](cyclopropylmet...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24ClNO4S/c26-22-12-8-20(9-13-22)21-10-14-23(15-11-21)32(30,31)27(17-19-6-7-19)24(25(28)29)16-18-4-2-1-3-5-18/h1-5,8-15,19,24H,6-7,16-17H2,(H,28,29)/t24-/m1/s1
PDB
MMDB

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair