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PubMed code 21903387

Compile data set for download or QSAR
Found 12 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Kallikrein 7


(Homo sapiens)
BDBM50355086
PNG
(CHEMBL1834753)
Show SMILES COc1cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c(O)c1-c1c(OC)cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c1O
Show InChI InChI=1S/C32H26O12/c1-11-7-13-21(31(37)43-11)25(33)19-15(29(13)41-5)9-17(39-3)23(27(19)35)24-18(40-4)10-16-20(28(24)36)26(34)22-14(30(16)42-6)8-12(2)44-32(22)38/h7-10,33-36H,1-6H3
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PubMed
1.22E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355088
PNG
(CHEMBL1834754)
Show SMILES COc1cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c(O)c1-c1c(OC)cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c1O
Show InChI InChI=1S/C30H26O10/c1-11-5-13-7-15-9-17(37-3)23(27(33)19(15)25(31)21(13)29(35)39-11)24-18(38-4)10-16-8-14-6-12(2)40-30(36)22(14)26(32)20(16)28(24)34/h7-12,31-34H,5-6H2,1-4H3/t11-,12-/m1/s1
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PubMed
2.29E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355086
PNG
(CHEMBL1834753)
Show SMILES COc1cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c(O)c1-c1c(OC)cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c1O
Show InChI InChI=1S/C32H26O12/c1-11-7-13-21(31(37)43-11)25(33)19-15(29(13)41-5)9-17(39-3)23(27(19)35)24-18(40-4)10-16-20(28(24)36)26(34)22-14(30(16)42-6)8-12(2)44-32(22)38/h7-10,33-36H,1-6H3
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PubMed
2.44E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 7


(Homo sapiens)
BDBM50355088
PNG
(CHEMBL1834754)
Show SMILES COc1cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c(O)c1-c1c(OC)cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c1O
Show InChI InChI=1S/C30H26O10/c1-11-5-13-7-15-9-17(37-3)23(27(33)19(15)25(31)21(13)29(35)39-11)24-18(38-4)10-16-8-14-6-12(2)40-30(36)22(14)26(32)20(16)28(24)34/h7-12,31-34H,5-6H2,1-4H3/t11-,12-/m1/s1
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PubMed
3.72E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355087
PNG
(CHEMBL1833982)
Show SMILES COc1cc(O)c2c(O)c3c(cc(C)oc3=O)c(OC)c2c1
Show InChI InChI=1S/C16H14O6/c1-7-4-9-13(16(19)22-7)14(18)12-10(15(9)21-3)5-8(20-2)6-11(12)17/h4-6,17-18H,1-3H3
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4.75E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 7


(Homo sapiens)
BDBM50355087
PNG
(CHEMBL1833982)
Show SMILES COc1cc(O)c2c(O)c3c(cc(C)oc3=O)c(OC)c2c1
Show InChI InChI=1S/C16H14O6/c1-7-4-9-13(16(19)22-7)14(18)12-10(15(9)21-3)5-8(20-2)6-11(12)17/h4-6,17-18H,1-3H3
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7.07E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355088
PNG
(CHEMBL1834754)
Show SMILES COc1cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c(O)c1-c1c(OC)cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c1O
Show InChI InChI=1S/C30H26O10/c1-11-5-13-7-15-9-17(37-3)23(27(33)19(15)25(31)21(13)29(35)39-11)24-18(38-4)10-16-8-14-6-12(2)40-30(36)22(14)26(32)20(16)28(24)34/h7-12,31-34H,5-6H2,1-4H3/t11-,12-/m1/s1
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n/an/a 5.37E+4n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355086
PNG
(CHEMBL1834753)
Show SMILES COc1cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c(O)c1-c1c(OC)cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c1O
Show InChI InChI=1S/C32H26O12/c1-11-7-13-21(31(37)43-11)25(33)19-15(29(13)41-5)9-17(39-3)23(27(19)35)24-18(40-4)10-16-20(28(24)36)26(34)22-14(30(16)42-6)8-12(2)44-32(22)38/h7-10,33-36H,1-6H3
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PubMed
n/an/a 7.29E+4n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 7


(Homo sapiens)
BDBM50355086
PNG
(CHEMBL1834753)
Show SMILES COc1cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c(O)c1-c1c(OC)cc2c(OC)c3cc(C)oc(=O)c3c(O)c2c1O
Show InChI InChI=1S/C32H26O12/c1-11-7-13-21(31(37)43-11)25(33)19-15(29(13)41-5)9-17(39-3)23(27(19)35)24-18(40-4)10-16-20(28(24)36)26(34)22-14(30(16)42-6)8-12(2)44-32(22)38/h7-10,33-36H,1-6H3
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n/an/a 1.12E+5n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 7


(Homo sapiens)
BDBM50355088
PNG
(CHEMBL1834754)
Show SMILES COc1cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c(O)c1-c1c(OC)cc2cc3C[C@@H](C)OC(=O)c3c(O)c2c1O
Show InChI InChI=1S/C30H26O10/c1-11-5-13-7-15-9-17(37-3)23(27(33)19(15)25(31)21(13)29(35)39-11)24-18(38-4)10-16-8-14-6-12(2)40-30(36)22(14)26(32)20(16)28(24)34/h7-12,31-34H,5-6H2,1-4H3/t11-,12-/m1/s1
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n/an/a 1.35E+5n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 7


(Homo sapiens)
BDBM50355087
PNG
(CHEMBL1833982)
Show SMILES COc1cc(O)c2c(O)c3c(cc(C)oc3=O)c(OC)c2c1
Show InChI InChI=1S/C16H14O6/c1-7-4-9-13(16(19)22-7)14(18)12-10(15(9)21-3)5-8(20-2)6-11(12)17/h4-6,17-18H,1-3H3
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n/an/a 1.66E+5n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 7 using Abz-KLYSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens)
BDBM50355087
PNG
(CHEMBL1833982)
Show SMILES COc1cc(O)c2c(O)c3c(cc(C)oc3=O)c(OC)c2c1
Show InChI InChI=1S/C16H14O6/c1-7-4-9-13(16(19)22-7)14(18)12-10(15(9)21-3)5-8(20-2)6-11(12)17/h4-6,17-18H,1-3H3
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n/an/a 3.67E+5n/an/an/an/an/an/a



Universidade Federal do Tri£ngulo Mineiro

Curated by ChEMBL


Assay Description
Inhibition of human kallikrein 5 using Abz-KLRSSKQ-EDDnp as substrate by spectrofluorimetric assay


Bioorg Med Chem Lett 21: 6112-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.044
BindingDB Entry DOI: 10.7270/Q24M94ZP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%