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Compile Data Set for Download or QSAR

Found 45 hits from A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine   
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
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155250
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CC(NC(=O)CCC(=O)Nc1ccc2CNCc2c1)c1ccccc1
Show InChI InChI=1S/C21H23N3O4/c25-19(23-17-7-6-15-12-22-13-16(15)10-17)8-9-20(26)24-18(11-21(27)28)14-4-2-1-3-5-14/h1-7,10,18,22H,8-9,11-13H2,(H,23,25)(H,24,26)(H,27,28)
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4.20n/an/an/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro binding affinity for FITC-labeled fibrinogen binding to alphaIIb-beta3 receptor of human platelets


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155251
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CCNC(=O)CCC(=O)Nc1ccc2CNCc2c1
Show InChI InChI=1S/C15H19N3O4/c19-13(17-6-5-15(21)22)3-4-14(20)18-12-2-1-10-8-16-9-11(10)7-12/h1-2,7,16H,3-6,8-9H2,(H,17,19)(H,18,20)(H,21,22)
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7.10n/an/an/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro binding affinity for FITC-labeled fibrinogen binding to alphaIIb-beta3 receptor of human platelets


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50323320
PNG
(3-(3,4-dimethoxyphenyl)-3-(3-(1,2,3,4-tetrahydrois...)
Show SMILES COc1ccc(cc1OC)C(CC(O)=O)NC(=O)c1cccc(c1)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C28H29N3O6/c1-36-24-9-7-18(14-25(24)37-2)23(15-26(32)33)31-28(35)20-5-3-4-19(12-20)27(34)30-22-8-6-17-10-11-29-16-21(17)13-22/h3-9,12-14,23,29H,10-11,15-16H2,1-2H3,(H,30,34)(H,31,35)(H,32,33)
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n/an/a 0.700n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50323319
PNG
(3-(3-(carbamoyl)benzamido)-3-(4-methoxyphenyl)prop...)
Show SMILES COc1ccc(cc1)C(CC(O)=O)NC(=O)c1cccc(c1)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C27H27N3O5/c1-35-23-9-6-18(7-10-23)24(15-25(31)32)30-27(34)20-4-2-3-19(13-20)26(33)29-22-8-5-17-11-12-28-16-21(17)14-22/h2-10,13-14,24,28H,11-12,15-16H2,1H3,(H,29,33)(H,30,34)(H,31,32)
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n/an/a 0.800n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50323318
PNG
(3-(3-(carbamoyl)benzamido)-3-phenylpropanoic acid ...)
Show SMILES OC(=O)CC(NC(=O)c1cccc(c1)C(=O)Nc1ccc2CCNCc2c1)c1ccccc1
Show InChI InChI=1S/C26H25N3O4/c30-24(31)15-23(18-5-2-1-3-6-18)29-26(33)20-8-4-7-19(13-20)25(32)28-22-10-9-17-11-12-27-16-21(17)14-22/h1-10,13-14,23,27H,11-12,15-16H2,(H,28,32)(H,29,33)(H,30,31)
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n/an/a 1n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50156364
PNG
(CHEMBL3786107)
Show SMILES Cl.Cl.NC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc2nc([nH]c(=O)c2c1)N1CCNCC1
Show InChI InChI=1S/C23H27N7O4.2ClH/c24-13-19(28-23(33)34-14-15-4-2-1-3-5-15)21(32)26-16-6-7-18-17(12-16)20(31)29-22(27-18)30-10-8-25-9-11-30;;/h1-7,12,19,25H,8-11,13-14,24H2,(H,26,32)(H,28,33)(H,27,29,31);2*1H/t19-;;/m0../s1
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n/an/a 1.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50156365
PNG
(CHEMBL3787524)
Show SMILES Cl.Cl.NCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc2nc([nH]c(=O)c2c1)N1CCNCC1
Show InChI InChI=1S/C24H29N7O4.2ClH/c25-9-8-20(29-24(34)35-15-16-4-2-1-3-5-16)22(33)27-17-6-7-19-18(14-17)21(32)30-23(28-19)31-12-10-26-11-13-31;;/h1-7,14,20,26H,8-13,15,25H2,(H,27,33)(H,29,34)(H,28,30,32);2*1H/t20-;;/m0../s1
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n/an/a 1.60n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50156363
PNG
(CHEMBL3786425)
Show SMILES Cl.Cl.CC(C)COC(=O)N[C@@H](CN)C(=O)Nc1ccc2nc([nH]c(=O)c2c1)N1CCNCC1
Show InChI InChI=1S/C20H29N7O4.2ClH/c1-12(2)11-31-20(30)25-16(10-21)18(29)23-13-3-4-15-14(9-13)17(28)26-19(24-15)27-7-5-22-6-8-27;;/h3-4,9,12,16,22H,5-8,10-11,21H2,1-2H3,(H,23,29)(H,25,30)(H,24,26,28);2*1H/t16-;;/m0../s1
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n/an/a 1.80n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50004058
PNG
((2S)-2-(butylsulfonylamino)-3-[4-(4-piperidin-4-yl...)
Show SMILES CCCCS(=O)(=O)N[C@@H](Cc1ccc(OCCCCC2CCNCC2)cc1)C(O)=O
Show InChI InChI=1S/C22H36N2O5S/c1-2-3-16-30(27,28)24-21(22(25)26)17-19-7-9-20(10-8-19)29-15-5-4-6-18-11-13-23-14-12-18/h7-10,18,21,23-24H,2-6,11-17H2,1H3,(H,25,26)/t21-/m0/s1
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n/an/a 1.90n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50004058
PNG
((2S)-2-(butylsulfonylamino)-3-[4-(4-piperidin-4-yl...)
Show SMILES CCCCS(=O)(=O)N[C@@H](Cc1ccc(OCCCCC2CCNCC2)cc1)C(O)=O
Show InChI InChI=1S/C22H36N2O5S/c1-2-3-16-30(27,28)24-21(22(25)26)17-19-7-9-20(10-8-19)29-15-5-4-6-18-11-13-23-14-12-18/h7-10,18,21,23-24H,2-6,11-17H2,1H3,(H,25,26)/t21-/m0/s1
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n/an/a 2.40n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50370766
PNG
(CHEMBL385939)
Show SMILES COc1ccc(cc1OC)C(CC(O)=O)NC(=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C28H28N4O8/c1-39-24-6-4-17(13-25(24)40-2)23(14-26(33)34)31-28(36)19-9-18(11-22(12-19)32(37)38)27(35)30-21-5-3-16-7-8-29-15-20(16)10-21/h3-6,9-13,23,29H,7-8,14-15H2,1-2H3,(H,30,35)(H,31,36)(H,33,34)
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n/an/a 3.70n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50370765
PNG
(CHEMBL219051)
Show SMILES COc1ccc(cc1)C(CC(O)=O)NC(=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C27H26N4O7/c1-38-23-6-3-17(4-7-23)24(14-25(32)33)30-27(35)19-10-18(12-22(13-19)31(36)37)26(34)29-21-5-2-16-8-9-28-15-20(16)11-21/h2-7,10-13,24,28H,8-9,14-15H2,1H3,(H,29,34)(H,30,35)(H,32,33)
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n/an/a 5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354350
PNG
(CHEMBL1836344)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)CCCC3CCNCC3)cc2C1=O
Show InChI InChI=1S/C20H27N3O4/c24-18(3-1-2-14-6-9-21-10-7-14)22-16-5-4-15-13-23(11-8-19(25)26)20(27)17(15)12-16/h4-5,12,14,21H,1-3,6-11,13H2,(H,22,24)(H,25,26)
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n/an/a 5.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354350
PNG
(CHEMBL1836344)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)CCCC3CCNCC3)cc2C1=O
Show InChI InChI=1S/C20H27N3O4/c24-18(3-1-2-14-6-9-21-10-7-14)22-16-5-4-15-13-23(11-8-19(25)26)20(27)17(15)12-16/h4-5,12,14,21H,1-3,6-11,13H2,(H,22,24)(H,25,26)
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n/an/a 5.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354355
PNG
(CHEMBL1836351)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C22H23N3O4/c1-13(8-20(26)27)25-12-16-4-5-18(10-19(16)22(25)29)24-21(28)15-3-2-14-6-7-23-11-17(14)9-15/h2-5,9-10,13,23H,6-8,11-12H2,1H3,(H,24,28)(H,26,27)
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n/an/a 6.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354355
PNG
(CHEMBL1836351)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C22H23N3O4/c1-13(8-20(26)27)25-12-16-4-5-18(10-19(16)22(25)29)24-21(28)15-3-2-14-6-7-23-11-17(14)9-15/h2-5,9-10,13,23H,6-8,11-12H2,1H3,(H,24,28)(H,26,27)
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n/an/a 6.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354352
PNG
(CHEMBL1836347)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C21H21N3O4/c25-19(26)6-8-24-12-15-3-4-17(10-18(15)21(24)28)23-20(27)14-2-1-13-5-7-22-11-16(13)9-14/h1-4,9-10,22H,5-8,11-12H2,(H,23,27)(H,25,26)
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n/an/a 6.5n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354352
PNG
(CHEMBL1836347)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C21H21N3O4/c25-19(26)6-8-24-12-15-3-4-17(10-18(15)21(24)28)23-20(27)14-2-1-13-5-7-22-11-16(13)9-14/h1-4,9-10,22H,5-8,11-12H2,(H,23,27)(H,25,26)
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A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354351
PNG
(CHEMBL1836345)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)c3ccc(cc3)C3CCNCC3)cc2C1=O
Show InChI InChI=1S/C23H25N3O4/c27-21(28)9-12-26-14-18-5-6-19(13-20(18)23(26)30)25-22(29)17-3-1-15(2-4-17)16-7-10-24-11-8-16/h1-6,13,16,24H,7-12,14H2,(H,25,29)(H,27,28)
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n/an/a 6.80n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354351
PNG
(CHEMBL1836345)
Show SMILES OC(=O)CCN1Cc2ccc(NC(=O)c3ccc(cc3)C3CCNCC3)cc2C1=O
Show InChI InChI=1S/C23H25N3O4/c27-21(28)9-12-26-14-18-5-6-19(13-20(18)23(26)30)25-22(29)17-3-1-15(2-4-17)16-7-10-24-11-8-16/h1-6,13,16,24H,7-12,14H2,(H,25,29)(H,27,28)
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n/an/a 6.80n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50370769
PNG
(CHEMBL218200)
Show SMILES OC(=O)CC(NC(=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)Nc1ccc2CCNCc2c1)c1ccccc1
Show InChI InChI=1S/C26H24N4O6/c31-24(32)14-23(17-4-2-1-3-5-17)29-26(34)19-10-18(12-22(13-19)30(35)36)25(33)28-21-7-6-16-8-9-27-15-20(16)11-21/h1-7,10-13,23,27H,8-9,14-15H2,(H,28,33)(H,29,34)(H,31,32)
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n/an/a 8n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155250
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CC(NC(=O)CCC(=O)Nc1ccc2CNCc2c1)c1ccccc1
Show InChI InChI=1S/C21H23N3O4/c25-19(23-17-7-6-15-12-22-13-16(15)10-17)8-9-20(26)24-18(11-21(27)28)14-4-2-1-3-5-14/h1-7,10,18,22H,8-9,11-13H2,(H,23,25)(H,24,26)(H,27,28)
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A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of FITC-labeled fibrinogen binding to alphaIIb-beta3 receptor of human platelets


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50370768
PNG
(CHEMBL219603)
Show SMILES OC(=O)CCNC(=O)c1cccc(c1)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C20H21N3O4/c24-18(25)7-9-22-19(26)14-2-1-3-15(10-14)20(27)23-17-5-4-13-6-8-21-12-16(13)11-17/h1-5,10-11,21H,6-9,12H2,(H,22,26)(H,23,27)(H,24,25)
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n/an/a 9n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155251
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CCNC(=O)CCC(=O)Nc1ccc2CNCc2c1
Show InChI InChI=1S/C15H19N3O4/c19-13(17-6-5-15(21)22)3-4-14(20)18-12-2-1-10-8-16-9-11(10)7-12/h1-2,7,16H,3-6,8-9H2,(H,17,19)(H,18,20)(H,21,22)
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n/an/a 10n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of FITC-labeled fibrinogen binding to alphaIIb-beta3 receptor of human platelets


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50156362
PNG
(CHEMBL3785983)
Show SMILES Cl.Cl.O=C(Nc1ccc2nc([nH]c(=O)c2c1)N1CCNCC1)c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C23H27N7O2.2ClH/c31-21(16-1-4-18(5-2-16)29-11-7-24-8-12-29)26-17-3-6-20-19(15-17)22(32)28-23(27-20)30-13-9-25-10-14-30;;/h1-6,15,24-25H,7-14H2,(H,26,31)(H,27,28,32);2*1H
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n/an/a 20n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354356
PNG
(CHEMBL1836355)
Show SMILES OC(=O)CCNC(=O)CCNC(=O)c1ccc2CCNCc2c1
Show InChI InChI=1S/C16H21N3O4/c20-14(18-8-5-15(21)22)4-7-19-16(23)12-2-1-11-3-6-17-10-13(11)9-12/h1-2,9,17H,3-8,10H2,(H,18,20)(H,19,23)(H,21,22)
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n/an/a 22n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50078448
PNG
(3-{[3-Oxo-2-(2-piperidin-4-yl-ethyl)-2,3-dihydro-1...)
Show SMILES OC(=O)CCNC(=O)c1ccc2CN(CCC3CCNCC3)C(=O)c2c1
Show InChI InChI=1S/C19H25N3O4/c23-17(24)5-9-21-18(25)14-1-2-15-12-22(19(26)16(15)11-14)10-6-13-3-7-20-8-4-13/h1-2,11,13,20H,3-10,12H2,(H,21,25)(H,23,24)
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n/an/a 25n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Antagonist activity at integrin alpha2beta3-mediated aggregation in ADP-stimulated human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50370767
PNG
(CHEMBL218226)
Show SMILES OC(=O)CCNC(=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)Nc1ccc2CCNCc2c1
Show InChI InChI=1S/C20H20N4O6/c25-18(26)4-6-22-19(27)13-7-14(10-17(9-13)24(29)30)20(28)23-16-2-1-12-3-5-21-11-15(12)8-16/h1-2,7-10,21H,3-6,11H2,(H,22,27)(H,23,28)(H,25,26)
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n/an/a 32n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-Fg from integrin alpha2beta3 receptor expressed in human activated platelets


Bioorg Med Chem Lett 16: 5294-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.090
BindingDB Entry DOI: 10.7270/Q2MW2HZP
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354354
PNG
(CHEMBL1836350)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)c3ccc(cc3)N3CCNCC3)cc2C1=O
Show InChI InChI=1S/C23H26N4O4/c1-15(12-21(28)29)27-14-17-2-5-18(13-20(17)23(27)31)25-22(30)16-3-6-19(7-4-16)26-10-8-24-9-11-26/h2-7,13,15,24H,8-12,14H2,1H3,(H,25,30)(H,28,29)
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n/an/a 37n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354354
PNG
(CHEMBL1836350)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)c3ccc(cc3)N3CCNCC3)cc2C1=O
Show InChI InChI=1S/C23H26N4O4/c1-15(12-21(28)29)27-14-17-2-5-18(13-20(17)23(27)31)25-22(30)16-3-6-19(7-4-16)26-10-8-24-9-11-26/h2-7,13,15,24H,8-12,14H2,1H3,(H,25,30)(H,28,29)
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A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50156352
PNG
(CHEMBL3785489)
Show SMILES Cl.CCC(=O)Nc1ccc2nc([nH]c(=O)c2c1)N1CCNCC1
Show InChI InChI=1S/C15H19N5O2.ClH/c1-2-13(21)17-10-3-4-12-11(9-10)14(22)19-15(18-12)20-7-5-16-6-8-20;/h3-4,9,16H,2,5-8H2,1H3,(H,17,21)(H,18,19,22);1H
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n/an/a 55n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labelled fibrinogen binding to integrin alpha2b beta3 receptor in human platelet cells


Bioorg Med Chem Lett 26: 1839-43 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.011
BindingDB Entry DOI: 10.7270/Q2NV9M57
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354348
PNG
(CHEMBL1836342)
Show SMILES OC(=O)CN1Cc2ccc(NC(=O)c3ccc(cc3)C3CCNCC3)cc2C1=O
Show InChI InChI=1S/C22H23N3O4/c26-20(27)13-25-12-17-5-6-18(11-19(17)22(25)29)24-21(28)16-3-1-14(2-4-16)15-7-9-23-10-8-15/h1-6,11,15,23H,7-10,12-13H2,(H,24,28)(H,26,27)
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n/an/a 270n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354348
PNG
(CHEMBL1836342)
Show SMILES OC(=O)CN1Cc2ccc(NC(=O)c3ccc(cc3)C3CCNCC3)cc2C1=O
Show InChI InChI=1S/C22H23N3O4/c26-20(27)13-25-12-17-5-6-18(11-19(17)22(25)29)24-21(28)16-3-1-14(2-4-16)15-7-9-23-10-8-15/h1-6,11,15,23H,7-10,12-13H2,(H,24,28)(H,26,27)
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A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155250
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CC(NC(=O)CCC(=O)Nc1ccc2CNCc2c1)c1ccccc1
Show InChI InChI=1S/C21H23N3O4/c25-19(23-17-7-6-15-12-22-13-16(15)10-17)8-9-20(26)24-18(11-21(27)28)14-4-2-1-3-5-14/h1-7,10,18,22H,8-9,11-13H2,(H,23,25)(H,24,26)(H,27,28)
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n/an/a 270n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of human platelet aggregation in suspension


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50031552
PNG
(3-[3-(4-Carbamimidoyl-phenylcarbamoyl)-propionylam...)
Show SMILES NC(=N)c1ccc(NC(=O)CCC(=O)NC(CC(O)=O)c2ccccc2)cc1
Show InChI InChI=1S/C20H22N4O4/c21-20(22)14-6-8-15(9-7-14)23-17(25)10-11-18(26)24-16(12-19(27)28)13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H3,21,22)(H,23,25)(H,24,26)(H,27,28)
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n/an/a 290n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of Collagen-induced platelet aggregation in canine platelet rich plasma


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354353
PNG
(CHEMBL1836348)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)CCCC3CCNCC3)cc2C1=O
Show InChI InChI=1S/C21H29N3O4/c1-14(11-20(26)27)24-13-16-5-6-17(12-18(16)21(24)28)23-19(25)4-2-3-15-7-9-22-10-8-15/h5-6,12,14-15,22H,2-4,7-11,13H2,1H3,(H,23,25)(H,26,27)
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n/an/a 350n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354353
PNG
(CHEMBL1836348)
Show SMILES CC(CC(O)=O)N1Cc2ccc(NC(=O)CCCC3CCNCC3)cc2C1=O
Show InChI InChI=1S/C21H29N3O4/c1-14(11-20(26)27)24-13-16-5-6-17(12-18(16)21(24)28)23-19(25)4-2-3-15-7-9-22-10-8-15/h5-6,12,14-15,22H,2-4,7-11,13H2,1H3,(H,23,25)(H,26,27)
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n/an/a 350n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155250
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CC(NC(=O)CCC(=O)Nc1ccc2CNCc2c1)c1ccccc1
Show InChI InChI=1S/C21H23N3O4/c25-19(23-17-7-6-15-12-22-13-16(15)10-17)8-9-20(26)24-18(11-21(27)28)14-4-2-1-3-5-14/h1-7,10,18,22H,8-9,11-13H2,(H,23,25)(H,24,26)(H,27,28)
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n/an/a 860n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of human platelet aggregation in platelet rich plasma


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50031564
PNG
(3-[3-(4-Carbamimidoyl-phenylcarbamoyl)-propionylam...)
Show SMILES NC(=N)c1ccc(NC(=O)CCC(=O)NCCC(O)=O)cc1
Show InChI InChI=1S/C14H18N4O4/c15-14(16)9-1-3-10(4-2-9)18-12(20)6-5-11(19)17-8-7-13(21)22/h1-4H,5-8H2,(H3,15,16)(H,17,19)(H,18,20)(H,21,22)
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n/an/a 1.09E+3n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of Collagen-induced platelet aggregation in canine platelet rich plasma


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50354349
PNG
(CHEMBL1836343)
Show SMILES OC(=O)CN1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C20H19N3O4/c24-18(25)11-23-10-14-3-4-16(8-17(14)20(23)27)22-19(26)13-2-1-12-5-6-21-9-15(12)7-13/h1-4,7-8,21H,5-6,9-11H2,(H,22,26)(H,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50354349
PNG
(CHEMBL1836343)
Show SMILES OC(=O)CN1Cc2ccc(NC(=O)c3ccc4CCNCc4c3)cc2C1=O
Show InChI InChI=1S/C20H19N3O4/c24-18(25)11-23-10-14-3-4-16(8-17(14)20(23)27)22-19(26)13-2-1-12-5-6-21-9-15(12)7-13/h1-4,7-8,21H,5-6,9-11H2,(H,22,26)(H,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155251
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CCNC(=O)CCC(=O)Nc1ccc2CNCc2c1
Show InChI InChI=1S/C15H19N3O4/c19-13(17-6-5-15(21)22)3-4-14(20)18-12-2-1-10-8-16-9-11(10)7-12/h1-2,7,16H,3-6,8-9H2,(H,17,19)(H,18,20)(H,21,22)
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n/an/a 2.09E+3n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of human platelet aggregation in suspension


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50155251
PNG
(3-[3-(2,3-Dihydro-1H-isoindol-5-ylcarbamoyl)-propi...)
Show SMILES OC(=O)CCNC(=O)CCC(=O)Nc1ccc2CNCc2c1
Show InChI InChI=1S/C15H19N3O4/c19-13(17-6-5-15(21)22)3-4-14(20)18-12-2-1-10-8-16-9-11(10)7-12/h1-2,7,16H,3-6,8-9H2,(H,17,19)(H,18,20)(H,21,22)
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n/an/a 2.75E+3n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
In vitro inhibition of human platelet aggregation in platelet rich plasma


Bioorg Med Chem Lett 14: 5533-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.002
BindingDB Entry DOI: 10.7270/Q2J38T9M
More data for this
Ligand-Target Pair
Integrin alpha-2/beta-3


(Homo sapiens (Human)-Homo sapiens (human))
BDBM50241180
PNG
((6S,12S,15S)-1,6-diamino-12-(carboxymethyl)-16-hyd...)
Show SMILES N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C15H27N7O8/c16-7(2-1-3-19-15(17)18)12(27)20-5-10(24)21-8(4-11(25)26)13(28)22-9(6-23)14(29)30/h7-9,23H,1-6,16H2,(H,20,27)(H,21,24)(H,22,28)(H,25,26)(H,29,30)(H4,17,18,19)/t7-,8-,9-/m0/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled fibrinogen from alpha2beta3 in human platelets


Bioorg Med Chem Lett 21: 5971-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.063
BindingDB Entry DOI: 10.7270/Q26Q1XNS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50241180
PNG
((6S,12S,15S)-1,6-diamino-12-(carboxymethyl)-16-hyd...)
Show SMILES N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C15H27N7O8/c16-7(2-1-3-19-15(17)18)12(27)20-5-10(24)21-8(4-11(25)26)13(28)22-9(6-23)14(29)30/h7-9,23H,1-6,16H2,(H,20,27)(H,21,24)(H,22,28)(H,25,26)(H,29,30)(H4,17,18,19)/t7-,8-,9-/m0/s1
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PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



A.V. Bogatsky Physico-Chemical Institute of the National Academy of Sciences of Ukraine

Curated by ChEMBL


Assay Description
Inhibition of FITC-labeled fibrinogen binding to integrin alpha2bbeta3 receptor in human platelets by flow cytometry


Bioorg Med Chem 21: 4646-61 (2013)


Article DOI: 10.1016/j.bmc.2013.05.019
BindingDB Entry DOI: 10.7270/Q2Q81FGX
More data for this
Ligand-Target Pair