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PubMed code 12467632

Compile data set for download or QSAR
Found 13 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220483
PNG
(CHEMBL22213)
Show SMILES CCc1nc2c(ncnc2n1C(C1CC1)C1CC1)-c1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C21H20ClF3N4/c1-2-16-28-18-17(14-8-7-13(9-15(14)22)21(23,24)25)26-10-27-20(18)29(16)19(11-3-4-11)12-5-6-12/h7-12,19H,2-6H2,1H3
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1.80n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220492
PNG
(CHEMBL25256)
Show SMILES CCC[C@@H](C)n1c(CC)nc2c(nccc12)-c1ccc(OC(F)(F)F)cc1Cl
Show InChI InChI=1S/C20H21ClF3N3O/c1-4-6-12(3)27-16-9-10-25-18(19(16)26-17(27)5-2)14-8-7-13(11-15(14)21)28-20(22,23)24/h7-12H,4-6H2,1-3H3/t12-/m1/s1
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1.90n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220491
PNG
(CHEMBL422223)
Show SMILES CCC[C@H](C)n1c(CC)nc2c(nccc12)-c1ccc(OC(F)(F)F)cc1Cl
Show InChI InChI=1S/C20H21ClF3N3O/c1-4-6-12(3)27-16-9-10-25-18(19(16)26-17(27)5-2)14-8-7-13(11-15(14)21)28-20(22,23)24/h7-12H,4-6H2,1-3H3/t12-/m0/s1
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2.30n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220495
PNG
(CHEMBL26610)
Show SMILES CCCC(C)n1c(CC)nc2c(nccc12)-c1ccc(OC(F)(F)F)cc1Cl
Show InChI InChI=1S/C20H21ClF3N3O/c1-4-6-12(3)27-16-9-10-25-18(19(16)26-17(27)5-2)14-8-7-13(11-15(14)21)28-20(22,23)24/h7-12H,4-6H2,1-3H3
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2.80n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220496
PNG
(CHEMBL24803)
Show SMILES CCC(C1CC1)n1c(CC)nc2c(nccc12)-c1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C21H21ClF3N3/c1-3-16(12-5-6-12)28-17-9-10-26-19(20(17)27-18(28)4-2)14-8-7-13(11-15(14)22)21(23,24)25/h7-12,16H,3-6H2,1-2H3
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2.90n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220497
PNG
(CHEMBL285666)
Show SMILES CCCC(C)n1c(CC)nc2c(nccc12)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C19H21Cl2N3/c1-4-6-12(3)24-16-9-10-22-18(19(16)23-17(24)5-2)14-8-7-13(20)11-15(14)21/h7-12H,4-6H2,1-3H3
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3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220487
PNG
(CHEMBL26347)
Show SMILES CCCC(C)n1c(CC)nc2c(nccc12)-c1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C20H21ClF3N3/c1-4-6-12(3)27-16-9-10-25-18(19(16)26-17(27)5-2)14-8-7-13(11-15(14)21)20(22,23)24/h7-12H,4-6H2,1-3H3
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3.5n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220498
PNG
(CHEMBL26346)
Show SMILES CCC(C1CC1)n1c(CC)nc2c(nccc12)-c1ccc(Cl)cc1C(F)(F)F
Show InChI InChI=1S/C21H21ClF3N3/c1-3-16(12-5-6-12)28-17-9-10-26-19(20(17)27-18(28)4-2)14-8-7-13(22)11-15(14)21(23,24)25/h7-12,16H,3-6H2,1-2H3
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4.40n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220490
PNG
(CHEMBL279954)
Show SMILES CCC(CC)n1c(CC)nc2c(nccc12)-c1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C20H21ClF3N3/c1-4-13(5-2)27-16-9-10-25-18(19(16)26-17(27)6-3)14-8-7-12(11-15(14)21)20(22,23)24/h7-11,13H,4-6H2,1-3H3
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5.40n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220488
PNG
(CHEMBL447475)
Show SMILES CCC(C)n1c(CC)nc2c(nccc12)-c1ccc(OC(F)(F)F)cc1Cl
Show InChI InChI=1S/C19H19ClF3N3O/c1-4-11(3)26-15-8-9-24-17(18(15)25-16(26)5-2)13-7-6-12(10-14(13)20)27-19(21,22)23/h6-11H,4-5H2,1-3H3
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7.80n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against CRF receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220493
PNG
(CHEMBL280722)
Show SMILES CCCC(C)n1c(CC)nc2c(nccc12)-c1ccc(OC(F)F)cc1C
Show InChI InChI=1S/C21H25F2N3O/c1-5-7-14(4)26-17-10-11-24-19(20(17)25-18(26)6-2)16-9-8-15(12-13(16)3)27-21(22)23/h8-12,14,21H,5-7H2,1-4H3
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9n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220489
PNG
(CHEMBL25132)
Show SMILES CCCC(C)n1c(CC)nc2c(nccc12)-c1ccc(Cl)cc1C
Show InChI InChI=1S/C20H24ClN3/c1-5-7-14(4)24-17-10-11-22-19(20(17)23-18(24)6-2)16-9-8-15(21)12-13(16)3/h8-12,14H,5-7H2,1-4H3
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9.10n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2


(Rattus norvegicus (rat)-RAT)
BDBM50220494
PNG
(CHEMBL24666)
Show SMILES CCC(C1CC1)n1c(CC)nc2c(nccc12)-c1ccc(Cl)cc1C
Show InChI InChI=1S/C21H24ClN3/c1-4-17(14-6-7-14)25-18-10-11-23-20(21(18)24-19(25)5-2)16-9-8-15(22)12-13(16)3/h8-12,14,17H,4-7H2,1-3H3
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14n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
In vitro binding affinity against Corticotropin releasing factor receptor in rat cortical homogenates


Bioorg Med Chem Lett 13: 129-31 (2003)


BindingDB Entry DOI: 10.7270/Q2DZ0BGD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%