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Compile Data Set for Download or QSAR

Found 11 hits of affinity data for UniProtKB/TrEMBL: Q04998   
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
Inhibin beta A chain


(Mus musculus)
BDBM50095122
PNG
(CHEMBL3589518)
Show SMILES CCn1c(nc2cc(NC(=O)COC)cc(C(=O)NCc3ccccc3)c12)-c1cccnc1
Show InChI InChI=1S/C25H25N5O3/c1-3-30-23-20(25(32)27-14-17-8-5-4-6-9-17)12-19(28-22(31)16-33-2)13-21(23)29-24(30)18-10-7-11-26-15-18/h4-13,15H,3,14,16H2,1-2H3,(H,27,32)(H,28,31)
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n/an/a 3.67E+3n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095126
PNG
(CHEMBL3589514)
Show SMILES COc1ccc(OC[C@@H](O)CN2CCC(O)CC2)c(CNCCc2cccnc2)c1
Show InChI InChI=1/C23H33N3O4/c1-29-22-4-5-23(30-17-21(28)16-26-11-7-20(27)8-12-26)19(13-22)15-25-10-6-18-3-2-9-24-14-18/h2-5,9,13-14,20-21,25,27-28H,6-8,10-12,15-17H2,1H3/t21-/s2
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n/an/a 4.18E+3n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095140
PNG
(CHEMBL3589516)
Show SMILES Cn1cc(CN2C[C@@H](CN(Cc3ccc(cc3)C#CC(C)(C)O)CC2=O)OCc2cccnc2)cn1
Show InChI InChI=1S/C15H11N3O3/c19-12(20)6-8-1-2-10-9(5-8)7-11-13(10)17-15(21)14-16-3-4-18(11)14/h1-5H,6-7H2,(H,17,21)(H,19,20)
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n/an/a 4.25E+3n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095125
PNG
(CHEMBL3589511)
Show SMILES CC(C)(O)C#Cc1ccc(CN2CCC[C@@H](CCC(=O)N3CCOCC3)C2)s1
Show InChI InChI=1/C22H32N2O3S/c1-22(2,26)10-9-19-6-7-20(28-19)17-23-11-3-4-18(16-23)5-8-21(25)24-12-14-27-15-13-24/h6-7,18,26H,3-5,8,11-17H2,1-2H3/t18-/s2
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n/an/a 4.42E+3n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095124
PNG
(CHEMBL3589512)
Show SMILES O[C@H](C1CCN(CC1)C(=O)CC[C@]1(Cc2cccc3ccccc23)CCC(=O)N1)c1cccnc1
Show InChI InChI=1/C29H33N3O3/c33-26-10-14-29(31-26,19-23-7-3-6-21-5-1-2-9-25(21)23)15-11-27(34)32-17-12-22(13-18-32)28(35)24-8-4-16-30-20-24/h1-9,16,20,22,28,35H,10-15,17-19H2,(H,31,33)/t28-,29+/s2
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n/an/a 2.36E+4n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095127
PNG
(CHEMBL3589515)
Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc2OCOc2c1)NC(=O)c1ccccc1
Show InChI InChI=1/C28H25N3O6/c32-26(18-6-2-1-3-7-18)30-22(12-17-10-11-24-25(13-17)37-16-36-24)27(33)31-23(28(34)35)14-19-15-29-21-9-5-4-8-20(19)21/h1-11,13,15,22-23,29H,12,14,16H2,(H,30,32)(H,31,33)(H,34,35)/t22-,23+/s2
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n/an/a 1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095144
PNG
(CHEMBL3589520)
Show SMILES COc1cccc(CO[C@H]2CN(CCc3ccccc3)C(=O)CN(C2)C(=O)[C@@H]2CNC(=O)C2)c1
Show InChI InChI=1S/C14H22N4O2/c19-14(20)11-5-4-10-3-1-9(7-12(10)8-11)2-6-13-15-17-18-16-13/h9-12H,1-8H2,(H,19,20)(H,15,16,17,18)/t9-,10+,11+,12-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095141
PNG
(CHEMBL3589517)
Show SMILES CCCn1ncc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)c1C
Show InChI InChI=1S/C16H11N3O5/c20-12(21)4-7-2-1-3-8-9(7)5-11-13(8)18-15(22)14-17-10(16(23)24)6-19(11)14/h1-3,6H,4-5H2,(H,18,22)(H,20,21)(H,23,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095123
PNG
(CHEMBL3589513)
Show SMILES Fc1cccc(CNC(=O)[C@@H]2CCC(=O)N(CCCN3CCCC3=O)C2)c1
Show InChI InChI=1/C20H26FN3O3/c21-17-5-1-4-15(12-17)13-22-20(27)16-7-8-19(26)24(14-16)11-3-10-23-9-2-6-18(23)25/h1,4-5,12,16H,2-3,6-11,13-14H2,(H,22,27)/t16-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095142
PNG
(CHEMBL1388300)
Show SMILES Cc1n[nH]c(O)c1C(c1ccc(o1)-c1ccccc1C(O)=O)c1c(C)n[nH]c1O
Show InChI InChI=1S/C14H9N3O3/c18-13-12-15-3-4-17(12)10-6-8-5-7(14(19)20)1-2-9(8)11(10)16-13/h1-5H,6H2,(H,16,18)(H,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair
Inhibin beta A chain


(Mus musculus)
BDBM50095143
PNG
(CHEMBL3589519)
Show SMILES OCCn1nc(C(=O)NCc2ccccc2)c2CN(CCc12)C1CCCC1
Show InChI InChI=1S/C14H9N3O3/c18-13-12-15-4-5-17(12)10-6-9-7(11(10)16-13)2-1-3-8(9)14(19)20/h1-5H,6H2,(H,16,18)(H,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Antagonist activity at activin A in mouse LbetaT2 cells transfected with -338 promoter region of FSHbeta gene conjugated to luciferase reporter asses...


Citation and Details
More data for this
Ligand-Target Pair