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Compile Data Set for Download or QSAR

Found 302 hits with Last Name = 'arakawa' and Initial = 'k'   
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
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559528
PNG
(CHEMBL3950588)
Show SMILES CCc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 3.90n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559538
PNG
(CHEMBL3908950)
Show SMILES CSc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 4.90n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559527
PNG
(CHEMBL3907970)
Show SMILES CCCc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 8.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559522
PNG
(CHEMBL3960449)
Show SMILES CC(C)Oc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559524
PNG
(CHEMBL3923809)
Show SMILES CCOc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559525
PNG
(CHEMBL3934976)
Show SMILES COc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559529
PNG
(CHEMBL3896936)
Show SMILES Cc1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(C)cc1 |r|
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559523
PNG
(CHEMBL3915296)
Show SMILES CCCOc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559539
PNG
(CHEMBL3980689)
Show SMILES CSc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)n[nH]c2C(F)(F)F)cc1 |r|
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n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559526
PNG
(CHEMBL3969998)
Show SMILES CC(C)c1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058973
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-12-7-6-11(8-13(12)17)24(22,23)19-14(20)9-18(15(19)21)10-4-2-1-3-5-10/h1-8H,9H2
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n/an/a 18n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559517
PNG
(Remogliflozin | Remogliflozin a)
Show SMILES CC(C)Oc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn(C(C)C)c2C)cc1 |r|
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n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058984
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-(3,4-dimethyl-p...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H14Cl2N2O4S/c1-10-3-4-12(7-11(10)2)20-9-16(22)21(17(20)23)26(24,25)13-5-6-14(18)15(19)8-13/h3-8H,9H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058990
PNG
(3-(3,4-Dimethoxy-benzenesulfonyl)-1-(3,4-dimethyl-...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1C(=O)CN(C1=O)c1ccc(C)c(C)c1
Show InChI InChI=1S/C19H20N2O6S/c1-12-5-6-14(9-13(12)2)20-11-18(22)21(19(20)23)28(24,25)15-7-8-16(26-3)17(10-15)27-4/h5-10H,11H2,1-4H3
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n/an/a 22n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058996
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3,4-dichloro-pheny...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H9Cl3N2O4S/c16-9-1-4-11(5-2-9)25(23,24)20-14(21)8-19(15(20)22)10-3-6-12(17)13(18)7-10/h1-7H,8H2
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n/an/a 23n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059007
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES COC(=O)c1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H14N2O6S/c1-25-16(21)12-7-9-14(10-8-12)26(23,24)19-15(20)11-18(17(19)22)13-5-3-2-4-6-13/h2-10H,11H2,1H3
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n/an/a 29n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058964
PNG
(3-(3,4-Dimethyl-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Cc1ccc(cc1C)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O4S/c1-12-8-9-15(10-13(12)2)24(22,23)19-16(20)11-18(17(19)21)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058969
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3,4-dimethyl-pheny...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O4S/c1-11-3-6-14(9-12(11)2)19-10-16(21)20(17(19)22)25(23,24)15-7-4-13(18)5-8-15/h3-9H,10H2,1-2H3
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n/an/a 35n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058972
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES O=C1CN(C(=O)N1S(=O)(=O)c1ccc(cc1)C#N)c1ccccc1
Show InChI InChI=1S/C16H11N3O4S/c17-10-12-6-8-14(9-7-12)24(22,23)19-15(20)11-18(16(19)21)13-4-2-1-3-5-13/h1-9H,11H2
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n/an/a 40n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559519
PNG
(CHEMBL4786882)
Show SMILES CCn1nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(Cc2ccc(OC(C)C)cc2)c1C |r|
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n/an/a 43n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymotrypsinogen A


(Bos taurus (bovine))
BDBM50058977
PNG
(3-Benzoyl-1-phenyl-imidazolidine-2,4-dione | CHEMB...)
Show SMILES Oc1cn(-c2ccccc2)c(=O)n1C(=O)c1ccccc1
Show InChI InChI=1S/C16H12N2O3/c19-14-11-17(13-9-5-2-6-10-13)16(21)18(14)15(20)12-7-3-1-4-8-12/h1-11,19H
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n/an/a 48n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreas alpha-chymotrypsin in vitro


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559537
PNG
(CHEMBL3972664)
Show SMILES CCc1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(SC)cc1 |r|
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n/an/a 51n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50559829
PNG
(CHEMBL4784510)
Show SMILES COc1cc(F)c([C@@H]2CNC(=O)[C@H]2NC(=O)Nc2ccccc2)c(F)c1 |r|
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n/an/a 57n/an/an/an/an/an/a


TBA

Assay Description
Agonist activity at FPR2 in human HL-60 cells assessed as reduction in chemoattractant induced chemotaxis by luminescence cell viability assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.9b02101
BindingDB Entry DOI: 10.7270/Q2V98CSC
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058999
PNG
(3-(3,4-Dimethyl-benzenesulfonyl)-1-(3,4-dimethyl-p...)
Show SMILES Cc1ccc(cc1C)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(C)c(C)c1
Show InChI InChI=1S/C19H20N2O4S/c1-12-5-7-16(9-14(12)3)20-11-18(22)21(19(20)23)26(24,25)17-8-6-13(2)15(4)10-17/h5-10H,11H2,1-4H3
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n/an/a 60n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059002
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3-chloro-phenyl)-i...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-10-4-6-13(7-5-10)24(22,23)19-14(20)9-18(15(19)21)12-3-1-2-11(17)8-12/h1-8H,9H2
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n/an/a 66n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559518
PNG
(CHEMBL4787524)
Show SMILES CCCn1nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(Cc2ccc(OC(C)C)cc2)c1C |r|
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n/an/a 66n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058975
PNG
(3-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES O=C1CN(C(=O)N1S(=O)(=O)c1cccc(c1)C#N)c1ccccc1
Show InChI InChI=1S/C16H11N3O4S/c17-10-12-5-4-8-14(9-12)24(22,23)19-15(20)11-18(16(19)21)13-6-2-1-3-7-13/h1-9H,11H2
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n/an/a 68n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058994
PNG
(3-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES COC(=O)c1cccc(c1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H14N2O6S/c1-25-16(21)12-6-5-9-14(10-12)26(23,24)19-15(20)11-18(17(19)22)13-7-3-2-4-8-13/h2-10H,11H2,1H3
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n/an/a 82n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559532
PNG
(CHEMBL4765036)
Show SMILES OC[C@H]1O[C@@H](Oc2n[nH]c3cccc(CCc4ccccc4)c23)[C@H](O)[C@@H](O)[C@@H]1O |r|
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n/an/a 86n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559539
PNG
(CHEMBL3980689)
Show SMILES CSc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)n[nH]c2C(F)(F)F)cc1 |r|
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n/an/a 109n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT1 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059014
PNG
(3-(3,4-Dimethoxy-benzenesulfonyl)-1-phenyl-imidazo...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O6S/c1-24-14-9-8-13(10-15(14)25-2)26(22,23)19-16(20)11-18(17(19)21)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559520
PNG
(CHEMBL4785821)
Show SMILES CC(C)Oc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn(C)c2C)cc1 |r|
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TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059000
PNG
(3-(3-Chloro-benzenesulfonyl)-1-phenyl-imidazolidin...)
Show SMILES Clc1cccc(c1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H11ClN2O4S/c16-11-5-4-8-13(9-11)23(21,22)18-14(19)10-17(15(18)20)12-6-2-1-3-7-12/h1-9H,10H2
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n/an/a 130n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559532
PNG
(CHEMBL4765036)
Show SMILES OC[C@H]1O[C@@H](Oc2n[nH]c3cccc(CCc4ccccc4)c23)[C@H](O)[C@@H](O)[C@@H]1O |r|
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n/an/a 150n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT1 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559536
PNG
(CHEMBL4795938)
Show SMILES CSc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)n[nH]c2C(C)C)cc1 |r|
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n/an/a 154n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059003
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-(3,4-dichloro-p...)
Show SMILES Clc1ccc(cc1Cl)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H8Cl4N2O4S/c16-10-3-1-8(5-12(10)18)20-7-14(22)21(15(20)23)26(24,25)9-2-4-11(17)13(19)6-9/h1-6H,7H2
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n/an/a 170n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059005
PNG
(3-(4-Bromo-benzenesulfonyl)-1-phenyl-imidazolidine...)
Show SMILES Brc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H11BrN2O4S/c16-11-6-8-13(9-7-11)23(21,22)18-14(19)10-17(15(18)20)12-4-2-1-3-5-12/h1-9H,10H2
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n/an/a 170n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50559535
PNG
(CHEMBL4793115)
Show SMILES Cc1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccccc1 |r|
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n/an/a 181n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT2 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymotrypsinogen A


(Bos taurus (bovine))
BDBM50059002
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(3-chloro-phenyl)-i...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-10-4-6-13(7-5-10)24(22,23)19-14(20)9-18(15(19)21)12-3-1-2-11(17)8-12/h1-8H,9H2
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n/an/a 200n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreas alpha-chymotrypsin in vitro


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens (Human))
BDBM50058964
PNG
(3-(3,4-Dimethyl-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Cc1ccc(cc1C)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O4S/c1-12-8-9-15(10-13(12)2)24(22,23)19-16(20)11-18(17(19)21)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3
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n/an/a 220n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human neutrophil cathepsin G.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058982
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(2-chloro-phenyl)-i...)
Show SMILES Oc1cn(-c2ccccc2Cl)c(=O)n1S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-10-5-7-11(8-6-10)24(22,23)19-14(20)9-18(15(19)21)13-4-2-1-3-12(13)17/h1-9,20H
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n/an/a 220n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Chymotrypsinogen A


(Bos taurus (bovine))
BDBM50059013
PNG
(3-(4-Chloro-benzoyl)-1-phenyl-imidazolidine-2,4-di...)
Show SMILES Oc1cn(-c2ccccc2)c(=O)n1C(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H11ClN2O3/c17-12-8-6-11(7-9-12)15(21)19-14(20)10-18(16(19)22)13-4-2-1-3-5-13/h1-10,20H
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n/an/a 230n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreas alpha-chymotrypsin in vitro


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens (Human))
BDBM50058973
PNG
(3-(3,4-Dichloro-benzenesulfonyl)-1-phenyl-imidazol...)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-12-7-6-11(8-13(12)17)24(22,23)19-14(20)9-18(15(19)21)10-4-2-1-3-5-10/h1-8H,9H2
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n/an/a 230n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human neutrophil cathepsin G.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559528
PNG
(CHEMBL3950588)
Show SMILES CCc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
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TBA

Assay Description
Inhibition of human SGLT1 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50059011
PNG
(3-(4-Chloro-benzenesulfonyl)-1-(4-chloro-phenyl)-i...)
Show SMILES Clc1ccc(cc1)N1CC(=O)N(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H10Cl2N2O4S/c16-10-1-5-12(6-2-10)18-9-14(20)19(15(18)21)24(22,23)13-7-3-11(17)4-8-13/h1-8H,9H2
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n/an/a 300n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559529
PNG
(CHEMBL3896936)
Show SMILES Cc1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(C)cc1 |r|
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n/an/a 321n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT1 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens (Human))
BDBM50058972
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES O=C1CN(C(=O)N1S(=O)(=O)c1ccc(cc1)C#N)c1ccccc1
Show InChI InChI=1S/C16H11N3O4S/c17-10-12-6-8-14(9-7-12)24(22,23)19-15(20)11-18(16(19)21)13-4-2-1-3-5-13/h1-9H,11H2
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n/an/a 330n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human neutrophil cathepsin G.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Cathepsin G


(Homo sapiens (Human))
BDBM50059007
PNG
(4-(2,5-Dioxo-3-phenyl-imidazolidine-1-sulfonyl)-be...)
Show SMILES COC(=O)c1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C17H14N2O6S/c1-25-16(21)12-7-9-14(10-8-12)26(23,24)19-15(20)11-18(17(19)22)13-5-3-2-4-6-13/h2-10H,11H2,1H3
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B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 340n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human neutrophil cathepsin G.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559527
PNG
(CHEMBL3907970)
Show SMILES CCCc1ccc(Cc2c(C)[nH]nc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 345n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SGLT1 expressed in COS7 cells assessed as reduction in [14C]-AMG uptake


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116033
BindingDB Entry DOI: 10.7270/Q29G5RHZ
More data for this
Ligand-Target Pair
Chymase


(Homo sapiens (Human))
BDBM50058998
PNG
(3-(4-Fluoro-benzenesulfonyl)-1-phenyl-imidazolidin...)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C15H11FN2O4S/c16-11-6-8-13(9-7-11)23(21,22)18-14(19)10-17(15(18)20)12-4-2-1-3-5-12/h1-9H,10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 370n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against human heart chymase in vitro.


J Med Chem 40: 2156-63 (1997)


Article DOI: 10.1021/jm960793t
BindingDB Entry DOI: 10.7270/Q2QJ7GDG
More data for this
Ligand-Target Pair
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