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PubMed code 23659209

Compile data set for download or QSAR
Found 30 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
Chymase


(Homo sapiens (human))
BDBM50434109
PNG
(CHEMBL2381483)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H22BrN3O4/c1-2-5-15(10-21(28)29)26-19-7-4-3-6-18(19)25(22(26)30)12-13-8-14(23)9-17-16(13)11-20(27)24-17/h3-4,6-9,15H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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n/an/a 40n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Chymase


(Homo sapiens (human))
BDBM50434124
PNG
(CHEMBL2381480)
Show SMILES CCCC(Cn1c2ccccc2n(Cc2cc(Br)cc3[nH]c(=O)sc23)c1=O)C(O)=O
Show InChI InChI=1S/C21H20BrN3O4S/c1-2-5-12(19(26)27)10-24-16-6-3-4-7-17(16)25(21(24)29)11-13-8-14(22)9-15-18(13)30-20(28)23-15/h3-4,6-9,12H,2,5,10-11H2,1H3,(H,23,28)(H,26,27)
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n/an/a 50n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50349191
PNG
(CHEMBL1807642)
Show SMILES Cc1cccc2scc(Cn3c(SCCCC(O)=O)nc4ccccc34)c12
Show InChI InChI=1S/C21H20N2O2S2/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22-21(23)26-11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25)
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n/an/a 52n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434108
PNG
(CHEMBL2381482)
Show SMILES CCCC(Cn1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O)C(O)=O
Show InChI InChI=1S/C22H22BrN3O4/c1-2-5-13(21(28)29)11-25-18-6-3-4-7-19(18)26(22(25)30)12-14-8-15(23)9-17-16(14)10-20(27)24-17/h3-4,6-9,13H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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n/an/a 60n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50349192
PNG
(CHEMBL1807643)
Show SMILES Cc1cccc2scc(Cn3c4ccccc4n(CCCC(O)=O)c3=O)c12
Show InChI InChI=1S/C21H20N2O3S/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22(21(23)26)11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25)
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n/an/a 97n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Chymase


(Homo sapiens (human))
BDBM50434110
PNG
(CHEMBL2381484)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cc(Cl)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H22ClN3O4/c1-2-5-15(10-21(28)29)26-19-7-4-3-6-18(19)25(22(26)30)12-13-8-14(23)9-17-16(13)11-20(27)24-17/h3-4,6-9,15H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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n/an/a 240n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50349192
PNG
(CHEMBL1807643)
Show SMILES Cc1cccc2scc(Cn3c4ccccc4n(CCCC(O)=O)c3=O)c12
Show InChI InChI=1S/C21H20N2O3S/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22(21(23)26)11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434107
PNG
(CHEMBL2381481)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cccc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H23N3O4/c1-2-6-15(11-21(27)28)25-19-10-4-3-9-18(19)24(22(25)29)13-14-7-5-8-17-16(14)12-20(26)23-17/h3-5,7-10,15H,2,6,11-13H2,1H3,(H,23,26)(H,27,28)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434123
PNG
(CHEMBL2381479)
Show SMILES OC(=O)CCCSc1nc2ccccc2n1Cc1cc(Cl)cc2NC(=O)Cc12
Show InChI InChI=1S/C20H18ClN3O3S/c21-13-8-12(14-10-18(25)22-16(14)9-13)11-24-17-5-2-1-4-15(17)23-20(24)28-7-3-6-19(26)27/h1-2,4-5,8-9H,3,6-7,10-11H2,(H,22,25)(H,26,27)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434111
PNG
(CHEMBL2381485)
Show SMILES OC(=O)CCn1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C19H16BrN3O4/c20-12-7-11(13-9-17(24)21-14(13)8-12)10-23-16-4-2-1-3-15(16)22(19(23)27)6-5-18(25)26/h1-4,7-8H,5-6,9-10H2,(H,21,24)(H,25,26)
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n/an/a 2.30E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434123
PNG
(CHEMBL2381479)
Show SMILES OC(=O)CCCSc1nc2ccccc2n1Cc1cc(Cl)cc2NC(=O)Cc12
Show InChI InChI=1S/C20H18ClN3O3S/c21-13-8-12(14-10-18(25)22-16(14)9-13)11-24-17-5-2-1-4-15(17)23-20(24)28-7-3-6-19(26)27/h1-2,4-5,8-9H,3,6-7,10-11H2,(H,22,25)(H,26,27)
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n/an/a 3.80E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434112
PNG
(CHEMBL2381487)
Show SMILES OC(=O)CCn1c2ccccc2n(Cc2cc(Cl)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C19H16ClN3O4/c20-12-7-11(13-9-17(24)21-14(13)8-12)10-23-16-4-2-1-3-15(16)22(19(23)27)6-5-18(25)26/h1-4,7-8H,5-6,9-10H2,(H,21,24)(H,25,26)
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n/an/a 3.80E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434109
PNG
(CHEMBL2381483)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H22BrN3O4/c1-2-5-15(10-21(28)29)26-19-7-4-3-6-18(19)25(22(26)30)12-13-8-14(23)9-17-16(13)11-20(27)24-17/h3-4,6-9,15H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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n/an/a 5.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434112
PNG
(CHEMBL2381487)
Show SMILES OC(=O)CCn1c2ccccc2n(Cc2cc(Cl)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C19H16ClN3O4/c20-12-7-11(13-9-17(24)21-14(13)8-12)10-23-16-4-2-1-3-15(16)22(19(23)27)6-5-18(25)26/h1-4,7-8H,5-6,9-10H2,(H,21,24)(H,25,26)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434111
PNG
(CHEMBL2381485)
Show SMILES OC(=O)CCn1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C19H16BrN3O4/c20-12-7-11(13-9-17(24)21-14(13)8-12)10-23-16-4-2-1-3-15(16)22(19(23)27)6-5-18(25)26/h1-4,7-8H,5-6,9-10H2,(H,21,24)(H,25,26)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434124
PNG
(CHEMBL2381480)
Show SMILES CCCC(Cn1c2ccccc2n(Cc2cc(Br)cc3[nH]c(=O)sc23)c1=O)C(O)=O
Show InChI InChI=1S/C21H20BrN3O4S/c1-2-5-12(19(26)27)10-24-16-6-3-4-7-17(16)25(21(24)29)11-13-8-14(22)9-15-18(13)30-20(28)23-15/h3-4,6-9,12H,2,5,10-11H2,1H3,(H,23,28)(H,26,27)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434110
PNG
(CHEMBL2381484)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cc(Cl)cc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H22ClN3O4/c1-2-5-15(10-21(28)29)26-19-7-4-3-6-18(19)25(22(26)30)12-13-8-14(23)9-17-16(13)11-20(27)24-17/h3-4,6-9,15H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434107
PNG
(CHEMBL2381481)
Show SMILES CCCC(CC(O)=O)n1c2ccccc2n(Cc2cccc3NC(=O)Cc23)c1=O
Show InChI InChI=1S/C22H23N3O4/c1-2-6-15(11-21(27)28)25-19-10-4-3-9-18(19)24(22(25)29)13-14-7-5-8-17-16(14)12-20(26)23-17/h3-5,7-10,15H,2,6,11-13H2,1H3,(H,23,26)(H,27,28)
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Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434108
PNG
(CHEMBL2381482)
Show SMILES CCCC(Cn1c2ccccc2n(Cc2cc(Br)cc3NC(=O)Cc23)c1=O)C(O)=O
Show InChI InChI=1S/C22H22BrN3O4/c1-2-5-13(21(28)29)11-25-18-6-3-4-7-19(18)26(22(25)30)12-14-8-15(23)9-17-16(14)10-20(27)24-17/h3-4,6-9,13H,2,5,10-12H2,1H3,(H,24,27)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434116
PNG
(CHEMBL2381489)
Show SMILES Clc1ccc2sc(=O)[nH]c2c1
Show InChI InChI=1S/C7H4ClNOS/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)
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n/an/a 9.00E+4n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434114
PNG
(CHEMBL511085)
Show SMILES Clc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C8H6ClN/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,10H
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n/an/a 3.40E+5n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434122
PNG
(CHEMBL1232568)
Show SMILES Clc1ccc2CC(=O)Nc2c1
Show InChI InChI=1S/C8H6ClNO/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3H2,(H,10,11)
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n/an/a 4.70E+5n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Chymase


(Homo sapiens (human))
BDBM50434121
PNG
(CHEMBL2381492)
Show SMILES Brc1ccc2CC(=O)Nc2c1
Show InChI InChI=1S/C8H6BrNO/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3H2,(H,10,11)
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n/an/a 5.70E+5n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Chymase


(Homo sapiens (human))
BDBM50434117
PNG
(CHEMBL2381488)
Show SMILES Clc1cccc2CC(=O)Nc12
Show InChI InChI=1S/C8H6ClNO/c9-6-3-1-2-5-4-7(11)10-8(5)6/h1-3H,4H2,(H,10,11)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434115
PNG
(CHEMBL2381490)
Show SMILES CN1C(=O)Cc2ccc(Cl)cc12
Show InChI InChI=1S/C9H8ClNO/c1-11-8-5-7(10)3-2-6(8)4-9(11)12/h2-3,5H,4H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens)
BDBM50434122
PNG
(CHEMBL1232568)
Show SMILES Clc1ccc2CC(=O)Nc2c1
Show InChI InChI=1S/C8H6ClNO/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3H2,(H,10,11)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin G using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434120
PNG
(OXINDOLE)
Show SMILES O=C1Cc2ccccc2N1
Show InChI InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434119
PNG
(CHEMBL2380324)
Show SMILES Clc1cccc2NC(=O)Cc12
Show InChI InChI=1S/C8H6ClNO/c9-6-2-1-3-7-5(6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (human))
BDBM50434113
PNG
(CHEMBL2381486)
Show SMILES Clc1ccc2CNC(=O)c2c1
Show InChI InChI=1S/C8H6ClNO/c9-6-2-1-5-4-10-8(11)7(5)3-6/h1-3H,4H2,(H,10,11)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Chymase


(Homo sapiens (human))
BDBM50434118
PNG
(CHEMBL2381491)
Show SMILES Clc1ccc2NC(=O)Cc2c1
Show InChI InChI=1S/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human chymase using bis(succinoyl-L-alanyl-L-prolyl-L-phenylalanylamide) as substrate after 1 hr by fluorescence assay


J Med Chem 56: 4465-81 (2013)


Article DOI: 10.1021/jm400138z
BindingDB Entry DOI: 10.7270/Q2C82BPN
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%