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Compile Data Set for Download or QSAR

Found 43 hits Enz. Inhib. hit(s) with all data for entry = 50040004   
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


(Rattus norvegicus (rat))
BDBM50387635
PNG
(CHEMBL2058338)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C)c(OC)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C22H24ClN3O2/c1-5-18(14-6-7-14)26-21-20(25-13(3)22(26)27)15(8-9-24-21)16-10-12(2)19(28-4)11-17(16)23/h8-11,14,18H,5-7H2,1-4H3
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n/an/a 0.680n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387601
PNG
(CHEMBL2058596)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(F)c(cc3Cl)N(C)C)c2nc(C)c1=O
Show InChI InChI=1S/C22H24ClFN4O/c1-5-18(13-6-7-13)28-21-20(26-12(2)22(28)29)14(8-9-25-21)15-10-17(24)19(27(3)4)11-16(15)23/h8-11,13,18H,5-7H2,1-4H3
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n/an/a 0.820n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387603
PNG
(CHEMBL2058598)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C)c(Cl)cc3OC)c2nc(C)c1=O
Show InChI InChI=1S/C22H24ClN3O2/c1-5-18(14-6-7-14)26-21-20(25-13(3)22(26)27)15(8-9-24-21)16-10-12(2)17(23)11-19(16)28-4/h8-11,14,18H,5-7H2,1-4H3
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n/an/a 1.10n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387618
PNG
(CHEMBL2057479)
Show SMILES COCC(C1CC1)n1c2nccc(-c3cc(F)c(OC)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C21H21ClFN3O3/c1-11-21(27)26(17(10-28-2)12-4-5-12)20-19(25-11)13(6-7-24-20)14-8-16(23)18(29-3)9-15(14)22/h6-9,12,17H,4-5,10H2,1-3H3
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n/an/a 1.5n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387639
PNG
(CHEMBL2058593)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3cc(F)c(OC)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H21ClFN3O2/c1-4-17(12-5-6-12)26-20-19(25-11(2)21(26)27)13(7-8-24-20)14-9-16(23)18(28-3)10-15(14)22/h7-10,12,17H,4-6H2,1-3H3/t17-/m1/s1
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n/an/a 1.70n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387636
PNG
(CHEMBL2058589)
Show SMILES CCOc1cc(Cl)c(cc1C)-c1ccnc2n(C(CC)C3CC3)c(=O)c(C)nc12
Show InChI InChI=1S/C23H26ClN3O2/c1-5-19(15-7-8-15)27-22-21(26-14(4)23(27)28)16(9-10-25-22)17-11-13(3)20(29-6-2)12-18(17)24/h9-12,15,19H,5-8H2,1-4H3
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n/an/a 2n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387617
PNG
(CHEMBL2057478)
Show SMILES CCC(COC)n1c2nccc(-c3cc(F)c(OC)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C20H21ClFN3O3/c1-5-12(10-27-3)25-19-18(24-11(2)20(25)26)13(6-7-23-19)14-8-16(22)17(28-4)9-15(14)21/h6-9,12H,5,10H2,1-4H3
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n/an/a 2.10n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387616
PNG
(CHEMBL2057477)
Show SMILES COc1ccc(c(C)c1)-c1ccnc2n(C(C3CC3)C3CC3)c(=O)c(C)nc12
Show InChI InChI=1S/C23H25N3O2/c1-13-12-17(28-3)8-9-18(13)19-10-11-24-22-20(19)25-14(2)23(27)26(22)21(15-4-5-15)16-6-7-16/h8-12,15-16,21H,4-7H2,1-3H3
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n/an/a 3n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387604
PNG
(CHEMBL2058599)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(Cl)c(OC)cc3OC)c2nc(C)c1=O
Show InChI InChI=1S/C22H24ClN3O3/c1-5-17(13-6-7-13)26-21-20(25-12(2)22(26)27)14(8-9-24-21)15-10-16(23)19(29-4)11-18(15)28-3/h8-11,13,17H,5-7H2,1-4H3
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n/an/a 3.40n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387633
PNG
(CHEMBL2058336)
Show SMILES CC[C@@H](C1CC1)n1c2nccc(-c3ccc(OC)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H22ClN3O2/c1-4-18(13-5-6-13)25-20-19(24-12(2)21(25)26)16(9-10-23-20)15-8-7-14(27-3)11-17(15)22/h7-11,13,18H,4-6H2,1-3H3/t18-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387626
PNG
(CHEMBL2058329)
Show SMILES CC[C@H](COC)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C19H19Cl2N3O2/c1-4-13(10-26-3)24-18-17(23-11(2)19(24)25)15(7-8-22-18)14-6-5-12(20)9-16(14)21/h5-9,13H,4,10H2,1-3H3/t13-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387624
PNG
(CHEMBL2058327)
Show SMILES CCCC(C1CC1)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C21H21Cl2N3O/c1-3-4-18(13-5-6-13)26-20-19(25-12(2)21(26)27)16(9-10-24-20)15-8-7-14(22)11-17(15)23/h7-11,13,18H,3-6H2,1-2H3
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n/an/a 4.30n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387637
PNG
(CHEMBL2058591)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3cc(Cl)c(OC)cc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C22H24ClN3O2/c1-5-18(14-6-7-14)26-21-20(25-13(3)22(26)27)15(8-9-24-21)16-11-17(23)19(28-4)10-12(16)2/h8-11,14,18H,5-7H2,1-4H3/t18-/m1/s1
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n/an/a 4.5n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387634
PNG
(CHEMBL2058337)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3ccc(OC)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H22ClN3O2/c1-4-18(13-5-6-13)25-20-19(24-12(2)21(25)26)16(9-10-23-20)15-8-7-14(27-3)11-17(15)22/h7-11,13,18H,4-6H2,1-3H3/t18-/m1/s1
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n/an/a 4.5n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387602
PNG
(CHEMBL2058597)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C#N)c(C)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C22H21ClN4O/c1-4-19(14-5-6-14)27-21-20(26-13(3)22(27)28)16(7-8-25-21)17-10-15(11-24)12(2)9-18(17)23/h7-10,14,19H,4-6H2,1-3H3
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n/an/a 4.80n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387629
PNG
(CHEMBL2058332)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C)c(C)cc3C)c2nc(C)c1=O
Show InChI InChI=1S/C23H27N3O/c1-6-20(17-7-8-17)26-22-21(25-16(5)23(26)27)18(9-10-24-22)19-12-14(3)13(2)11-15(19)4/h9-12,17,20H,6-8H2,1-5H3
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n/an/a 5.20n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387632
PNG
(CHEMBL2058335)
Show SMILES CC[C@@H](C1CC1)n1c2nccc(-c3ccc(OC(F)F)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H20ClF2N3O2/c1-3-17(12-4-5-12)27-19-18(26-11(2)20(27)28)15(8-9-25-19)14-7-6-13(10-16(14)22)29-21(23)24/h6-10,12,17,21H,3-5H2,1-2H3/t17-/m0/s1
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n/an/a 7.30n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387623
PNG
(CHEMBL2058326)
Show SMILES CC[C@@H](C1CC1)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C20H19Cl2N3O/c1-3-17(12-4-5-12)25-19-18(24-11(2)20(25)26)15(8-9-23-19)14-7-6-13(21)10-16(14)22/h6-10,12,17H,3-5H2,1-2H3/t17-/m0/s1
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n/an/a 7.40n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387600
PNG
(CHEMBL2057474)
Show SMILES COCC(C1CC1)n1c2ncnc(-c3cc(F)c(OC)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C20H20ClFN4O3/c1-10-20(27)26(15(8-28-2)11-4-5-11)19-18(25-10)17(23-9-24-19)12-6-14(22)16(29-3)7-13(12)21/h6-7,9,11,15H,4-5,8H2,1-3H3
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n/an/a 7.5n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387622
PNG
(CHEMBL2058069)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C20H19Cl2N3O/c1-3-17(12-4-5-12)25-19-18(24-11(2)20(25)26)15(8-9-23-19)14-7-6-13(21)10-16(14)22/h6-10,12,17H,3-5H2,1-2H3/t17-/m1/s1
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n/an/a 8.20n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387628
PNG
(CHEMBL2058331)
Show SMILES CCC(C1CC1)n1c2nccc(-c3ccc(C)cc3C)c2nc(C)c1=O
Show InChI InChI=1S/C22H25N3O/c1-5-19(16-7-8-16)25-21-20(24-15(4)22(25)26)18(10-11-23-21)17-9-6-13(2)12-14(17)3/h6,9-12,16,19H,5,7-8H2,1-4H3
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n/an/a 8.80n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387640
PNG
(CHEMBL2058594)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3cc(F)c(OC)cc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C22H24FN3O2/c1-5-18(14-6-7-14)26-21-20(25-13(3)22(26)27)15(8-9-24-21)16-11-17(23)19(28-4)10-12(16)2/h8-11,14,18H,5-7H2,1-4H3/t18-/m1/s1
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n/an/a 9.40n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387638
PNG
(CHEMBL2058592)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(Cl)c(OC(F)F)cc3C)c2nc(C)c1=O
Show InChI InChI=1S/C22H22ClF2N3O2/c1-4-17(13-5-6-13)28-20-19(27-12(3)21(28)29)14(7-8-26-20)15-10-16(23)18(9-11(15)2)30-22(24)25/h7-10,13,17,22H,4-6H2,1-3H3
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n/an/a 9.70n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387605
PNG
(CHEMBL2058600)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3ccc(OC)cc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C22H25N3O2/c1-5-19(15-6-7-15)25-21-20(24-14(3)22(25)26)18(10-11-23-21)17-9-8-16(27-4)12-13(17)2/h8-12,15,19H,5-7H2,1-4H3/t19-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387599
PNG
(CHEMBL2058590)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C)c(OC(C)C)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C24H28ClN3O2/c1-6-20(16-7-8-16)28-23-22(27-15(5)24(28)29)17(9-10-26-23)18-11-14(4)21(12-19(18)25)30-13(2)3/h9-13,16,20H,6-8H2,1-5H3
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387608
PNG
(CHEMBL2058603)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3cc(C)c(OC)nc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C22H26N4O2/c1-6-18(15-7-8-15)26-20-19(24-14(4)22(26)27)16(9-10-23-20)17-11-12(2)21(28-5)25-13(17)3/h9-11,15,18H,6-8H2,1-5H3/t18-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387613
PNG
(CHEMBL2057473)
Show SMILES CCC(COC)n1c2ncnc(-c3cc(F)c(OC)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C19H20ClFN4O3/c1-5-11(8-27-3)25-18-17(24-10(2)19(25)26)16(22-9-23-18)12-6-14(21)15(28-4)7-13(12)20/h6-7,9,11H,5,8H2,1-4H3
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n/an/a 16n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387631
PNG
(CHEMBL2058334)
Show SMILES CC[C@@H](C1CC1)n1c2nccc(-c3ccc(cc3Cl)C(F)(F)F)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H19ClF3N3O/c1-3-17(12-4-5-12)28-19-18(27-11(2)20(28)29)15(8-9-26-19)14-7-6-13(10-16(14)22)21(23,24)25/h6-10,12,17H,3-5H2,1-2H3/t17-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387609
PNG
(CHEMBL2058604)
Show SMILES CC[C@@H](C1CC1)n1c2ncnc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C19H18Cl2N4O/c1-3-15(11-4-5-11)25-18-17(24-10(2)19(25)26)16(22-9-23-18)13-7-6-12(20)8-14(13)21/h6-9,11,15H,3-5H2,1-2H3/t15-/m0/s1
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n/an/a 24n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387612
PNG
(CHEMBL2057472)
Show SMILES COc1ccc(c(C)c1)-c1ncnc2n(C(C3CC3)C3CC3)c(=O)c(C)nc12
Show InChI InChI=1S/C22H24N4O2/c1-12-10-16(28-3)8-9-17(12)18-19-21(24-11-23-18)26(22(27)13(2)25-19)20(14-4-5-14)15-6-7-15/h8-11,14-15,20H,4-7H2,1-3H3
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n/an/a 37n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387611
PNG
(CHEMBL2058606)
Show SMILES CCC(C1CC1)n1c2ncnc(-c3cc(Cl)c(OC(F)F)cc3C)c2nc(C)c1=O
Show InChI InChI=1S/C21H21ClF2N4O2/c1-4-15(12-5-6-12)28-19-18(27-11(3)20(28)29)17(25-9-26-19)13-8-14(22)16(7-10(13)2)30-21(23)24/h7-9,12,15,21H,4-6H2,1-3H3
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n/an/a 38n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387641
PNG
(CHEMBL2058595)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(F)c(OC)cc3F)c2nc(C)c1=O
Show InChI InChI=1S/C21H21F2N3O2/c1-4-17(12-5-6-12)26-20-19(25-11(2)21(26)27)13(7-8-24-20)14-9-16(23)18(28-3)10-15(14)22/h7-10,12,17H,4-6H2,1-3H3
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n/an/a 52n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387614
PNG
(CHEMBL2057475)
Show SMILES CC[C@@H](C1CC1)n1c2ccnc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C20H19Cl2N3O/c1-3-16(12-4-5-12)25-17-8-9-23-18(19(17)24-11(2)20(25)26)14-7-6-13(21)10-15(14)22/h6-10,12,16H,3-5H2,1-2H3/t16-/m0/s1
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n/an/a 55n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387621
PNG
(CHEMBL2058068)
Show SMILES CCCC(C)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C19H19Cl2N3O/c1-4-5-11(2)24-18-17(23-12(3)19(24)25)15(8-9-22-18)14-7-6-13(20)10-16(14)21/h6-11H,4-5H2,1-3H3
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n/an/a 62n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387625
PNG
(CHEMBL2058328)
Show SMILES COCC(C)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C18H17Cl2N3O2/c1-10(9-25-3)23-17-16(22-11(2)18(23)24)14(6-7-21-17)13-5-4-12(19)8-15(13)20/h4-8,10H,9H2,1-3H3
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n/an/a 63n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387627
PNG
(CHEMBL2058330)
Show SMILES CC[C@@H](COC)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C19H19Cl2N3O2/c1-4-13(10-26-3)24-18-17(23-11(2)19(24)25)15(7-8-22-18)14-6-5-12(20)9-16(14)21/h5-9,13H,4,10H2,1-3H3/t13-/m0/s1
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n/an/a 74n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387606
PNG
(CHEMBL2058601)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3ccc(OC)nc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C21H24N4O2/c1-5-17(14-6-7-14)25-20-19(24-13(3)21(25)26)16(10-11-22-20)15-8-9-18(27-4)23-12(15)2/h8-11,14,17H,5-7H2,1-4H3/t17-/m1/s1
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n/an/a 76n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387610
PNG
(CHEMBL2058605)
Show SMILES CC[C@H](COC)n1c2ncnc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C18H18Cl2N4O2/c1-4-12(8-26-3)24-17-16(23-10(2)18(24)25)15(21-9-22-17)13-6-5-11(19)7-14(13)20/h5-7,9,12H,4,8H2,1-3H3/t12-/m1/s1
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n/an/a 97n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387607
PNG
(CHEMBL2058602)
Show SMILES CC[C@H](C1CC1)n1c2nccc(-c3cc(C)c(OC)cc3C)c2nc(C)c1=O |r|
Show InChI InChI=1S/C23H27N3O2/c1-6-19(16-7-8-16)26-22-21(25-15(4)23(26)27)17(9-10-24-22)18-11-14(3)20(28-5)12-13(18)2/h9-12,16,19H,6-8H2,1-5H3/t19-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387615
PNG
(CHEMBL2057476)
Show SMILES CC[C@H](COC)n1c2ccnc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O |r|
Show InChI InChI=1S/C19H19Cl2N3O2/c1-4-13(10-26-3)24-16-7-8-22-17(18(16)23-11(2)19(24)25)14-6-5-12(20)9-15(14)21/h5-9,13H,4,10H2,1-3H3/t13-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387630
PNG
(CHEMBL2058333)
Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C)c(C)c(C)c3C)c2nc(C)c1=O
Show InChI InChI=1S/C24H29N3O/c1-7-21(18-8-9-18)27-23-22(26-17(6)24(27)28)19(10-11-25-23)20-12-13(2)14(3)15(4)16(20)5/h10-12,18,21H,7-9H2,1-6H3
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n/an/a 340n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387620
PNG
(CHEMBL2058067)
Show SMILES CC(C)C(C)n1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C19H19Cl2N3O/c1-10(2)12(4)24-18-17(23-11(3)19(24)25)15(7-8-22-18)14-6-5-13(20)9-16(14)21/h5-10,12H,1-4H3
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n/an/a 380n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))
BDBM50387619
PNG
(CHEMBL2058066)
Show SMILES CC(C)Cn1c2nccc(-c3ccc(Cl)cc3Cl)c2nc(C)c1=O
Show InChI InChI=1S/C18H17Cl2N3O/c1-10(2)9-23-17-16(22-11(3)18(23)24)14(6-7-21-17)13-5-4-12(19)8-15(13)20/h4-8,10H,9H2,1-3H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Co

Curated by ChEMBL


Assay Description
Antagonist activity at rat CFR1R


Bioorg Med Chem Lett 22: 4986-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.034
BindingDB Entry DOI: 10.7270/Q23X87Q6
More data for this
Ligand-Target Pair