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Compile Data Set for Download or QSAR

Found 44 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha2/beta1' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446804
PNG
(CHEMBL3115061)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H16ClN3O4/c18-14-4-3-12-8-13(14)16(22)20-15(17(23)24)7-11-9-21(10-19-11)5-1-2-6-25-12/h1-4,8-10,15H,5-7H2,(H,20,22)(H,23,24)/b2-1+/t15-/m0/s1
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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446821
PNG
(CHEMBL3115056)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)c1ccccc21
Show InChI InChI=1S/C22H19ClN2O4/c23-18-8-7-15-12-17(18)21(26)24-19(22(27)28)11-14-13-25(9-3-4-10-29-15)20-6-2-1-5-16(14)20/h1-8,12-13,19H,9-11H2,(H,24,26)(H,27,28)/b4-3+/t19-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446818
PNG
(CHEMBL3115059)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)nn2
Show InChI InChI=1S/C16H15ClN4O4/c17-13-4-3-11-8-12(13)15(22)18-14(16(23)24)7-10-9-21(20-19-10)5-1-2-6-25-11/h1-4,8-9,14H,5-7H2,(H,18,22)(H,23,24)/b2-1+/t14-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446811
PNG
(CHEMBL3115067)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(n3)C(=O)N1)cn2
Show InChI InChI=1S/C16H15ClN4O4/c17-11-3-4-13-20-14(11)15(22)19-12(16(23)24)7-10-8-21(9-18-10)5-1-2-6-25-13/h1-4,8-9,12H,5-7H2,(H,19,22)(H,23,24)/b2-1+/t12-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446820
PNG
(CHEMBL3115057)
Show SMILES OC(=O)[C@@H]1Cn2cc(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)nn2
Show InChI InChI=1S/C16H15ClN4O4/c17-13-5-4-11-7-12(13)15(22)18-14(16(23)24)9-21-8-10(19-20-21)3-1-2-6-25-11/h1-2,4-5,7-8,14H,3,6,9H2,(H,18,22)(H,23,24)/b2-1+/t14-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446837
PNG
(CHEMBL3114869)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OC\C=C\COc3ccc(Cl)c(c3)C(=O)N1)cc2
Show InChI InChI=1S/C20H18ClNO5/c21-17-8-7-15-12-16(17)19(23)22-18(20(24)25)11-13-3-5-14(6-4-13)26-9-1-2-10-27-15/h1-8,12,18H,9-11H2,(H,22,23)(H,24,25)/b2-1+/t18-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446838
PNG
(CHEMBL3114868)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OCCCCOc3cccc(Cl)c3C(=O)N1)cc2
Show InChI InChI=1S/C20H20ClNO5/c21-15-4-3-5-17-18(15)19(23)22-16(20(24)25)12-13-6-8-14(9-7-13)26-10-1-2-11-27-17/h3-9,16H,1-2,10-12H2,(H,22,23)(H,24,25)/t16-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446845
PNG
(CHEMBL3114861)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3ccc(c(Cl)c3)C(=O)N1)c2
Show InChI InChI=1S/C20H20ClNO5/c21-17-12-15-6-7-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h3-7,10,12,18H,1-2,8-9,11H2,(H,22,23)(H,24,25)/t18-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446823
PNG
(CHEMBL3115054)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OC\C=C\COc3ccc(Cl)c(c3)C(=O)N1)nc2
Show InChI InChI=1S/C19H17ClN2O5/c20-15-5-4-13-10-14(15)18(23)22-16(19(24)25)9-12-3-6-17(21-11-12)27-8-2-1-7-26-13/h1-6,10-11,16H,7-9H2,(H,22,23)(H,24,25)/b2-1+/t16-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446843
PNG
(CHEMBL3114863)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3ccc(Cl)c(c3)C(=O)N1)c2
Show InChI InChI=1S/C20H20ClNO5/c21-17-7-6-15-12-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h3-7,10,12,18H,1-2,8-9,11H2,(H,22,23)(H,24,25)/t18-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446846
PNG
(CHEMBL3114860)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3ccc(c(Cl)c3)C(=O)N1)c2
Show InChI InChI=1S/C20H18ClNO5/c21-17-12-15-6-7-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h1-7,10,12,18H,8-9,11H2,(H,22,23)(H,24,25)/b2-1+/t18-/m0/s1
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n/an/a 163n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446805
PNG
(CHEMBL3115073)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\Cc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H16ClN3O3/c18-14-5-4-11-3-1-2-6-21-9-12(19-10-21)8-15(17(23)24)20-16(22)13(14)7-11/h1-2,4-5,7,9-10,15H,3,6,8H2,(H,20,22)(H,23,24)/b2-1+/t15-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446839
PNG
(CHEMBL3114867)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OC\C=C\COc3cccc(Cl)c3C(=O)N1)cc2
Show InChI InChI=1S/C20H18ClNO5/c21-15-4-3-5-17-18(15)19(23)22-16(20(24)25)12-13-6-8-14(9-7-13)26-10-1-2-11-27-17/h1-9,16H,10-12H2,(H,22,23)(H,24,25)/b2-1+/t16-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50117069
PNG
((S)-2-(2-Chloro-6-methyl-benzoylamino)-3-[4-(2,6-d...)
Show SMILES Cc1cccc(Cl)c1C(=O)N[C@@H](Cc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1)C(O)=O
Show InChI InChI=1S/C24H19Cl3N2O4/c1-13-4-2-5-16(25)20(13)22(30)29-19(24(32)33)12-14-8-10-15(11-9-14)28-23(31)21-17(26)6-3-7-18(21)27/h2-11,19H,12H2,1H3,(H,28,31)(H,29,30)(H,32,33)/t19-/m0/s1
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n/an/a 214n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446844
PNG
(CHEMBL3114862)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3ccc(Cl)c(c3)C(=O)N1)c2
Show InChI InChI=1S/C20H18ClNO5/c21-17-7-6-15-12-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h1-7,10,12,18H,8-9,11H2,(H,22,23)(H,24,25)/b2-1+/t18-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446807
PNG
(CHEMBL3115071)
Show SMILES OC(=O)[C@@H]1Cc2cn(CC\C=C\COc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C18H18ClN3O4/c19-15-5-4-13-9-14(15)17(23)21-16(18(24)25)8-12-10-22(11-20-12)6-2-1-3-7-26-13/h1,3-5,9-11,16H,2,6-8H2,(H,21,23)(H,24,25)/b3-1+/t16-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446816
PNG
(CHEMBL3115062)
Show SMILES OC(=O)[C@@H]1Cc2cn(CCCCOc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H18ClN3O4/c18-14-4-3-12-8-13(14)16(22)20-15(17(23)24)7-11-9-21(10-19-11)5-1-2-6-25-12/h3-4,8-10,15H,1-2,5-7H2,(H,20,22)(H,23,24)/t15-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446815
PNG
(CHEMBL3115063)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(c(Cl)c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H16ClN3O4/c18-14-8-12-3-4-13(14)16(22)20-15(17(23)24)7-11-9-21(10-19-11)5-1-2-6-25-12/h1-4,8-10,15H,5-7H2,(H,20,22)(H,23,24)/b2-1+/t15-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446817
PNG
(CHEMBL3115060)
Show SMILES OC(=O)[C@@H]1Cc2cn(CCCCOc3ccc(Cl)c(c3)C(=O)N1)nn2
Show InChI InChI=1S/C16H17ClN4O4/c17-13-4-3-11-8-12(13)15(22)18-14(16(23)24)7-10-9-21(20-19-10)5-1-2-6-25-11/h3-4,8-9,14H,1-2,5-7H2,(H,18,22)(H,23,24)/t14-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446842
PNG
(CHEMBL3114864)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3cccc(Cl)c3C(=O)N1)c2
Show InChI InChI=1S/C20H18ClNO5/c21-15-7-4-8-17-18(15)19(23)22-16(20(24)25)12-13-5-3-6-14(11-13)26-9-1-2-10-27-17/h1-8,11,16H,9-10,12H2,(H,22,23)(H,24,25)/b2-1+/t16-/m0/s1
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n/an/a 588n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446827
PNG
(CHEMBL3115050)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3ccc(c(c3)C(=O)N1)[N+]([O-])=O)c2
Show InChI InChI=1S/C20H18N2O7/c23-19-16-12-15(6-7-18(16)22(26)27)29-9-2-1-8-28-14-5-3-4-13(10-14)11-17(21-19)20(24)25/h1-7,10,12,17H,8-9,11H2,(H,21,23)(H,24,25)/b2-1+/t17-/m0/s1
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TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446806
PNG
(CHEMBL3115072)
Show SMILES OC(=O)[C@@H]1Cc2cn(CCCCCOc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C18H20ClN3O4/c19-15-5-4-13-9-14(15)17(23)21-16(18(24)25)8-12-10-22(11-20-12)6-2-1-3-7-26-13/h4-5,9-11,16H,1-3,6-8H2,(H,21,23)(H,24,25)/t16-/m0/s1
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n/an/a 731n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446836
PNG
(CHEMBL3114870)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OCCCCOc3ccc(Cl)c(c3)C(=O)N1)cc2
Show InChI InChI=1S/C20H20ClNO5/c21-17-8-7-15-12-16(17)19(23)22-18(20(24)25)11-13-3-5-14(6-4-13)26-9-1-2-10-27-15/h3-8,12,18H,1-2,9-11H2,(H,22,23)(H,24,25)/t18-/m0/s1
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n/an/a 731n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446834
PNG
(CHEMBL3114872)
Show SMILES Cc1ccc2OCCCCOc3cccc(C[C@H](NC(=O)c1c2)C(O)=O)c3
Show InChI InChI=1S/C21H23NO5/c1-14-7-8-17-13-18(14)20(23)22-19(21(24)25)12-15-5-4-6-16(11-15)26-9-2-3-10-27-17/h4-8,11,13,19H,2-3,9-10,12H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1
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n/an/a 745n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446822
PNG
(CHEMBL3115055)
Show SMILES OC(=O)[C@@H]1Cc2ccc(OCCCCOc3ccc(Cl)c(c3)C(=O)N1)nc2
Show InChI InChI=1S/C19H19ClN2O5/c20-15-5-4-13-10-14(15)18(23)22-16(19(24)25)9-12-3-6-17(21-11-12)27-8-2-1-7-26-13/h3-6,10-11,16H,1-2,7-9H2,(H,22,23)(H,24,25)/t16-/m0/s1
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n/an/a 792n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446812
PNG
(CHEMBL3115066)
Show SMILES OC(=O)[C@@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(c3Cl)C(=O)N1)cn2
Show InChI InChI=1S/C17H15Cl2N3O4/c18-11-3-4-13-15(19)14(11)16(23)21-12(17(24)25)7-10-8-22(9-20-10)5-1-2-6-26-13/h1-4,8-9,12H,5-7H2,(H,21,23)(H,24,25)/b2-1+/t12-/m0/s1
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n/an/a 869n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446814
PNG
(CHEMBL3115064)
Show SMILES OC(=O)[C@H]1Cc2cn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H16ClN3O4/c18-14-4-3-12-8-13(14)16(22)20-15(17(23)24)7-11-9-21(10-19-11)5-1-2-6-25-12/h1-4,8-10,15H,5-7H2,(H,20,22)(H,23,24)/b2-1+/t15-/m1/s1
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n/an/a 909n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446841
PNG
(CHEMBL3114865)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3cccc(Cl)c3C(=O)N1)c2
Show InChI InChI=1S/C20H20ClNO5/c21-15-7-4-8-17-18(15)19(23)22-16(20(24)25)12-13-5-3-6-14(11-13)26-9-1-2-10-27-17/h3-8,11,16H,1-2,9-10,12H2,(H,22,23)(H,24,25)/t16-/m0/s1
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n/an/a 978n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446824
PNG
(CHEMBL3115053)
Show SMILES OC(=O)[C@@H]1Cc2cccc(NCCCCOc3ccc(Cl)c(c3)C(=O)N1)n2
Show InChI InChI=1S/C19H20ClN3O4/c20-15-7-6-13-11-14(15)18(24)23-16(19(25)26)10-12-4-3-5-17(22-12)21-8-1-2-9-27-13/h3-7,11,16H,1-2,8-10H2,(H,21,22)(H,23,24)(H,25,26)/t16-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446832
PNG
(CHEMBL3114874)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3ccc(c(F)c3)C(=O)N1)c2
Show InChI InChI=1S/C20H18FNO5/c21-17-12-15-6-7-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h1-7,10,12,18H,8-9,11H2,(H,22,23)(H,24,25)/b2-1+/t18-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446825
PNG
(CHEMBL3115052)
Show SMILES OC(=O)[C@@H]1Cc2cccc(NC\C=C\COc3ccc(Cl)c(c3)C(=O)N1)n2
Show InChI InChI=1S/C19H18ClN3O4/c20-15-7-6-13-11-14(15)18(24)23-16(19(25)26)10-12-4-3-5-17(22-12)21-8-1-2-9-27-13/h1-7,11,16H,8-10H2,(H,21,22)(H,23,24)(H,25,26)/b2-1+/t16-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446829
PNG
(CHEMBL3114877)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3cccc(F)c3C(=O)N1)c2
Show InChI InChI=1S/C20H20FNO5/c21-15-7-4-8-17-18(15)19(23)22-16(20(24)25)12-13-5-3-6-14(11-13)26-9-1-2-10-27-17/h3-8,11,16H,1-2,9-10,12H2,(H,22,23)(H,24,25)/t16-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446830
PNG
(CHEMBL3114876)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3cccc(F)c3C(=O)N1)c2
Show InChI InChI=1S/C20H18FNO5/c21-15-7-4-8-17-18(15)19(23)22-16(20(24)25)12-13-5-3-6-14(11-13)26-9-1-2-10-27-17/h1-8,11,16H,9-10,12H2,(H,22,23)(H,24,25)/b2-1+/t16-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446833
PNG
(CHEMBL3114873)
Show SMILES Cc1ccc2OC\C=C\COc3cccc(C[C@H](NC(=O)c1c2)C(O)=O)c3
Show InChI InChI=1S/C21H21NO5/c1-14-7-8-17-13-18(14)20(23)22-19(21(24)25)12-15-5-4-6-16(11-15)26-9-2-3-10-27-17/h2-8,11,13,19H,9-10,12H2,1H3,(H,22,23)(H,24,25)/b3-2+/t19-/m0/s1
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n/an/a 1.05E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446819
PNG
(CHEMBL3115058)
Show SMILES OC(=O)[C@@H]1Cn2cc(CCCCOc3ccc(Cl)c(c3)C(=O)N1)nn2
Show InChI InChI=1S/C16H17ClN4O4/c17-13-5-4-11-7-12(13)15(22)18-14(16(23)24)9-21-8-10(19-20-21)3-1-2-6-25-11/h4-5,7-8,14H,1-3,6,9H2,(H,18,22)(H,23,24)/t14-/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446826
PNG
(CHEMBL3115051)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OC\C=C\COc3cc(c(cn3)C(=O)N1)C(F)(F)F)c2
Show InChI InChI=1S/C20H17F3N2O5/c21-20(22,23)15-10-17-24-11-14(15)18(26)25-16(19(27)28)9-12-4-3-5-13(8-12)29-6-1-2-7-30-17/h1-5,8,10-11,16H,6-7,9H2,(H,25,26)(H,27,28)/b2-1+/t16-/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446840
PNG
(CHEMBL3114866)
Show SMILES OC(=O)C1Cc2ccccc2OCCCCOc2ccc(Cl)c(c2)C(=O)N1
Show InChI InChI=1S/C20H20ClNO5/c21-16-8-7-14-12-15(16)19(23)22-17(20(24)25)11-13-5-1-2-6-18(13)27-10-4-3-9-26-14/h1-2,5-8,12,17H,3-4,9-11H2,(H,22,23)(H,24,25)
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n/an/a>4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446828
PNG
(CHEMBL3115049)
Show SMILES COc1cccc2OCCCCOc3cccc(C[C@H](NC(=O)c12)C(O)=O)c3
Show InChI InChI=1S/C21H23NO6/c1-26-17-8-5-9-18-19(17)20(23)22-16(21(24)25)13-14-6-4-7-15(12-14)27-10-2-3-11-28-18/h4-9,12,16H,2-3,10-11,13H2,1H3,(H,22,23)(H,24,25)/t16-/m0/s1
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n/an/a>4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446831
PNG
(CHEMBL3114875)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3ccc(c(F)c3)C(=O)N1)c2
Show InChI InChI=1S/C20H20FNO5/c21-17-12-15-6-7-16(17)19(23)22-18(20(24)25)11-13-4-3-5-14(10-13)26-8-1-2-9-27-15/h3-7,10,12,18H,1-2,8-9,11H2,(H,22,23)(H,24,25)/t18-/m0/s1
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n/an/a>4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446813
PNG
(CHEMBL3115065)
Show SMILES OC(=O)[C@H]1Cc2cn(CCCCOc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C17H18ClN3O4/c18-14-4-3-12-8-13(14)16(22)20-15(17(23)24)7-11-9-21(10-19-11)5-1-2-6-25-12/h3-4,8-10,15H,1-2,5-7H2,(H,20,22)(H,23,24)/t15-/m1/s1
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n/an/a>4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446810
PNG
(CHEMBL3115068)
Show SMILES OC(=O)[C@@H]1Cc2ncn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)c2Cl
Show InChI InChI=1S/C17H15Cl2N3O4/c18-12-4-3-10-7-11(12)16(23)21-14(17(24)25)8-13-15(19)22(9-20-13)5-1-2-6-26-10/h1-4,7,9,14H,5-6,8H2,(H,21,23)(H,24,25)/b2-1+/t14-/m0/s1
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n/an/a>4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446809
PNG
(CHEMBL3115069)
Show SMILES OC(=O)C1CCc2cn(C\C=C\COc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C18H18ClN3O4/c19-15-5-4-13-9-14(15)17(23)21-16(18(24)25)6-3-12-10-22(11-20-12)7-1-2-8-26-13/h1-2,4-5,9-11,16H,3,6-8H2,(H,21,23)(H,24,25)/b2-1+
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n/an/a>5.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446808
PNG
(CHEMBL3115070)
Show SMILES OC(=O)C1CCc2cn(CCCCOc3ccc(Cl)c(c3)C(=O)N1)cn2
Show InChI InChI=1S/C18H20ClN3O4/c19-15-5-4-13-9-14(15)17(23)21-16(18(24)25)6-3-12-10-22(11-20-12)7-1-2-8-26-13/h4-5,9-11,16H,1-3,6-8H2,(H,21,23)(H,24,25)
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n/an/a>5.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair
Integrin alpha2/beta1


(Homo sapiens (human))
BDBM50446835
PNG
(CHEMBL3114871)
Show SMILES OC(=O)[C@@H]1Cc2cccc(OCCCCOc3cccc(c3)C(=O)N1)c2
Show InChI InChI=1S/C20H21NO5/c22-19-15-6-4-8-17(13-15)26-10-2-1-9-25-16-7-3-5-14(11-16)12-18(21-19)20(23)24/h3-8,11,13,18H,1-2,9-10,12H2,(H,21,22)(H,23,24)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
Article
n/an/a>1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...


Citation and Details
More data for this
Ligand-Target Pair