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Compile Data Set for Download or QSAR

Found 41 hits Enz. Inhib. hit(s) with all data for entry = 50019320   
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


(Homo sapiens (Human))
BDBM50203626
PNG
(CHEMBL247557 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(3.16,-28.04,;4.15,-29.22,;5.67,-28.95,;6.66,-30.13,;8.18,-29.86,;8.7,-28.41,;7.71,-27.23,;8.24,-25.78,;7.25,-24.61,;5.73,-24.88,;5.21,-26.33,;6.2,-27.51,;6.14,-31.58,;7.13,-32.75,;6.76,-34.25,;5.33,-34.83,;8.07,-35.06,;9.24,-34.07,;10.78,-33.96,;11.77,-35.15,;13.28,-34.88,;13.8,-33.43,;14.27,-36.05,;13.75,-37.5,;14.74,-38.68,;12.23,-37.77,;11.24,-36.59,;9.72,-36.85,;11.16,-32.48,;12.53,-31.75,;12.58,-30.21,;11.26,-29.38,;9.9,-30.11,;9.85,-31.65,;8.67,-32.64,)|
Show InChI InChI=1S/C29H32ClN5/c1-5-15-33(16-13-23-10-7-6-8-11-23)19-26-22(4)32-29-34(26)25-12-9-14-31-28(25)35(29)27-21(3)17-20(2)18-24(27)30/h6-12,14,17-18H,5,13,15-16,19H2,1-4H3
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5.90n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203611
PNG
(CHEMBL393044 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCN(CC1CCC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(16.3,-32.74,;17.29,-33.92,;18.81,-33.65,;19.8,-34.83,;21.32,-34.56,;21.84,-33.11,;23.23,-32.46,;22.58,-31.07,;21.19,-31.72,;19.28,-36.27,;20.27,-37.45,;19.9,-38.95,;18.47,-39.53,;21.21,-39.76,;22.39,-38.77,;23.93,-38.66,;24.92,-39.84,;26.42,-39.57,;26.94,-38.13,;27.41,-40.75,;26.89,-42.2,;27.88,-43.38,;25.37,-42.47,;24.38,-41.29,;22.86,-41.55,;24.3,-37.18,;25.67,-36.45,;25.73,-34.9,;24.41,-34.08,;23.04,-34.81,;22.99,-36.35,;21.81,-37.34,)|
Show InChI InChI=1S/C26H32ClN5/c1-5-12-30(15-20-8-6-9-20)16-23-19(4)29-26-31(23)22-10-7-11-28-25(22)32(26)24-18(3)13-17(2)14-21(24)27/h7,10-11,13-14,20H,5-6,8-9,12,15-16H2,1-4H3
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6n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203587
PNG
(CHEMBL392655 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(16.66,-44.12,;18.18,-43.85,;19.17,-45.03,;20.68,-44.76,;21.21,-43.31,;20.22,-42.13,;20.74,-40.69,;19.75,-39.51,;18.24,-39.78,;17.71,-41.24,;18.71,-42.41,;18.65,-46.48,;19.64,-47.66,;19.27,-49.15,;17.84,-49.73,;20.57,-49.96,;21.75,-48.98,;23.29,-48.87,;24.28,-50.05,;25.79,-49.78,;26.31,-48.33,;26.78,-50.95,;26.25,-52.41,;27.24,-53.59,;24.73,-52.67,;23.75,-51.49,;22.23,-51.76,;23.67,-47.38,;25.03,-46.66,;25.09,-45.11,;23.77,-44.29,;22.41,-45.01,;22.35,-46.55,;21.17,-47.55,)|
Show InChI InChI=1S/C28H30ClN5/c1-5-32(15-13-22-10-7-6-8-11-22)18-25-21(4)31-28-33(25)24-12-9-14-30-27(24)34(28)26-20(3)16-19(2)17-23(26)29/h6-12,14,16-17H,5,13,15,18H2,1-4H3
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6.40n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203625
PNG
(CHEMBL246501 | ethyl-[2-methyl-8-(2,4,6-trimethyl-...)
Show SMILES CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(38.71,1.01,;38.18,-.44,;36.66,-.71,;35.88,.62,;34.34,.6,;33.55,1.92,;34.31,3.25,;33.52,4.58,;31.98,4.56,;31.23,3.2,;32.02,1.89,;36.14,-2.15,;37.13,-3.33,;36.76,-4.83,;35.34,-5.41,;38.07,-5.64,;39.25,-4.65,;40.79,-4.54,;41.78,-5.72,;43.28,-5.45,;43.81,-4.01,;44.27,-6.63,;43.75,-8.08,;44.74,-9.26,;42.23,-8.35,;41.24,-7.17,;39.73,-7.43,;41.16,-3.06,;42.53,-2.33,;42.59,-.78,;41.27,.04,;39.91,-.69,;39.85,-2.23,;38.67,-3.22,)|
Show InChI InChI=1S/C29H33N5/c1-6-32(16-14-24-11-8-7-9-12-24)19-26-23(5)31-29-33(26)25-13-10-15-30-28(25)34(29)27-21(3)17-20(2)18-22(27)4/h7-13,15,17-18H,6,14,16,19H2,1-5H3
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7.80n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203598
PNG
(CHEMBL397389 | cyclobutylmethyl-[2-methyl-8-(2,4,6...)
Show SMILES CCCN(CC1CCC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(24.76,4.65,;23.25,4.38,;22.72,2.93,;21.2,2.66,;20.42,3.99,;18.88,3.97,;17.77,5.05,;16.7,3.94,;17.8,2.87,;20.68,1.22,;21.67,.04,;21.3,-1.46,;19.88,-2.04,;22.61,-2.27,;23.79,-1.28,;25.33,-1.17,;26.32,-2.35,;27.82,-2.08,;28.35,-.64,;28.81,-3.26,;28.29,-4.71,;29.28,-5.89,;26.77,-4.98,;25.78,-3.8,;24.27,-4.06,;25.7,.32,;27.07,1.04,;27.13,2.59,;25.81,3.41,;24.45,2.68,;24.39,1.14,;23.21,.15,)|
Show InChI InChI=1S/C27H35N5/c1-6-13-30(16-22-9-7-10-22)17-24-21(5)29-27-31(24)23-11-8-12-28-26(23)32(27)25-19(3)14-18(2)15-20(25)4/h8,11-12,14-15,22H,6-7,9-10,13,16-17H2,1-5H3
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8.20n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203621
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-(3-phe...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCC(C1)c1ccccc1 |w:26.32,(5.93,-4.83,;7.36,-4.25,;8.67,-5.07,;9.84,-4.08,;11.38,-3.97,;12.37,-5.15,;13.88,-4.88,;14.4,-3.43,;14.87,-6.05,;14.34,-7.51,;15.34,-8.69,;12.83,-7.78,;11.84,-6.6,;10.32,-6.86,;11.76,-2.48,;13.13,-1.76,;13.18,-.21,;11.81,.68,;10.5,-.12,;10.45,-1.66,;9.26,-2.65,;7.73,-2.76,;6.74,-1.58,;7.26,-.13,;8.73,.29,;8.78,1.83,;7.34,2.35,;6.39,1.14,;6.91,3.83,;7.99,4.94,;7.56,6.4,;6.07,6.78,;5,5.67,;5.43,4.19,)|
Show InChI InChI=1S/C28H28ClN5/c1-18-14-19(2)26(23(29)15-18)34-27-24(10-7-12-30-27)33-25(20(3)31-28(33)34)17-32-13-11-22(16-32)21-8-5-4-6-9-21/h4-10,12,14-15,22H,11,13,16-17H2,1-3H3
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8.40n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203590
PNG
(CHEMBL395929 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCN(CC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(6.49,-8.21,;7.48,-9.39,;8.99,-9.12,;9.99,-10.29,;11.5,-10.02,;12.03,-8.57,;13.19,-7.59,;11.74,-7.06,;9.46,-11.74,;10.45,-12.92,;10.09,-14.42,;8.66,-14.99,;11.39,-15.23,;12.57,-14.24,;14.11,-14.13,;15.1,-15.31,;16.6,-15.05,;17.13,-13.6,;17.6,-16.22,;17.07,-17.67,;18.06,-18.85,;15.56,-17.94,;14.56,-16.76,;13.05,-17.03,;14.48,-12.65,;15.85,-11.92,;15.91,-10.37,;14.59,-9.55,;13.23,-10.27,;13.17,-11.81,;11.99,-12.81,)|
Show InChI InChI=1S/C25H30ClN5/c1-5-11-29(14-19-8-9-19)15-22-18(4)28-25-30(22)21-7-6-10-27-24(21)31(25)23-17(3)12-16(2)13-20(23)26/h6-7,10,12-13,19H,5,8-9,11,14-15H2,1-4H3
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11n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203609
PNG
(CHEMBL247151 | allyl-[8-(2-chloro-4,6-dimethyl-phe...)
Show SMILES CCCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(-10.99,4.06,;-10,2.89,;-8.48,3.16,;-7.49,1.98,;-5.97,2.25,;-5.45,3.7,;-3.93,3.97,;-8.01,.53,;-7.02,-.65,;-7.39,-2.14,;-8.82,-2.72,;-6.08,-2.95,;-4.91,-1.97,;-3.37,-1.86,;-2.38,-3.04,;-.87,-2.77,;-.35,-1.32,;.12,-3.94,;-.41,-5.4,;.59,-6.58,;-1.92,-5.66,;-2.91,-4.48,;-4.43,-4.75,;-2.99,-.37,;-1.62,.35,;-1.57,1.9,;-2.89,2.72,;-4.25,2,;-4.3,.46,;-5.48,-.54,)|
Show InChI InChI=1S/C24H28ClN5/c1-6-11-28(12-7-2)15-21-18(5)27-24-29(21)20-9-8-10-26-23(20)30(24)22-17(4)13-16(3)14-19(22)25/h6,8-10,13-14H,1,7,11-12,15H2,2-5H3
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11n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203589
PNG
(CHEMBL391141 | cyclopropylmethyl-[2-methyl-8-(2,4,...)
Show SMILES CCCN(CC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(6.48,-8.21,;7.47,-9.39,;8.99,-9.12,;9.98,-10.3,;11.5,-10.03,;12.02,-8.58,;13.19,-7.59,;11.74,-7.06,;9.46,-11.74,;10.45,-12.92,;10.08,-14.42,;8.65,-15,;11.39,-15.23,;12.57,-14.24,;14.11,-14.13,;15.1,-15.31,;16.6,-15.05,;17.12,-13.6,;17.6,-16.22,;17.07,-17.68,;18.05,-18.85,;15.55,-17.94,;14.56,-16.77,;13.05,-17.02,;14.48,-12.65,;15.85,-11.92,;15.91,-10.37,;14.59,-9.55,;13.22,-10.28,;13.17,-11.82,;11.98,-12.82,)|
Show InChI InChI=1S/C26H33N5/c1-6-12-29(15-21-9-10-21)16-23-20(5)28-26-30(23)22-8-7-11-27-25(22)31(26)24-18(3)13-17(2)14-19(24)4/h7-8,11,13-14,21H,6,9-10,12,15-16H2,1-5H3
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15n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203624
PNG
(CHEMBL393250 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(17.27,3.89,;18.26,2.71,;19.78,2.99,;20.77,1.81,;22.28,2.08,;22.81,3.53,;24.32,3.8,;20.24,.36,;21.24,-.82,;20.87,-2.31,;19.44,-2.89,;22.17,-3.13,;23.35,-2.14,;24.89,-2.03,;25.88,-3.21,;27.39,-2.94,;27.91,-1.49,;28.38,-4.11,;27.85,-5.57,;28.84,-6.75,;26.33,-5.83,;25.35,-4.65,;23.83,-4.92,;25.27,-.54,;26.63,.18,;26.69,1.73,;25.37,2.55,;24.01,1.83,;23.95,.29,;22.77,-.71,)|
Show InChI InChI=1S/C24H30ClN5/c1-6-11-28(12-7-2)15-21-18(5)27-24-29(21)20-9-8-10-26-23(20)30(24)22-17(4)13-16(3)14-19(22)25/h8-10,13-14H,6-7,11-12,15H2,1-5H3
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15n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203610
PNG
(CHEMBL247359 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(31.17,-11.99,;32.16,-13.17,;33.68,-12.9,;34.67,-14.08,;36.19,-13.81,;36.71,-12.36,;38.23,-12.09,;39.67,-12.61,;39.4,-11.1,;34.15,-15.53,;35.14,-16.7,;34.77,-18.2,;33.34,-18.78,;36.08,-19.01,;37.26,-18.02,;38.8,-17.92,;39.78,-19.1,;41.29,-18.83,;41.81,-17.38,;42.28,-20,;41.76,-21.46,;42.75,-22.64,;40.24,-21.72,;39.25,-20.54,;37.73,-20.81,;39.17,-16.43,;40.54,-15.71,;40.59,-14.16,;39.27,-13.33,;37.91,-14.06,;37.86,-15.6,;36.68,-16.59,)|
Show InChI InChI=1S/C26H32ClN5/c1-5-12-30(13-10-20-8-9-20)16-23-19(4)29-26-31(23)22-7-6-11-28-25(22)32(26)24-18(3)14-17(2)15-21(24)27/h6-7,11,14-15,20H,5,8-10,12-13,16H2,1-4H3
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15n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203608
PNG
(CHEMBL245671 | cyclopropylmethyl-propyl-[2-trifluo...)
Show SMILES CCCN(CC1CC1)Cc1c(nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)C(F)(F)F |(-3.33,4.87,;-4.85,4.6,;-5.37,3.15,;-6.89,2.88,;-7.68,4.2,;-9.22,4.18,;-10.56,4.94,;-10.54,3.4,;-7.41,1.43,;-6.42,.25,;-6.79,-1.24,;-5.48,-2.06,;-4.31,-1.07,;-2.77,-.96,;-1.78,-2.14,;-.27,-1.87,;.25,-.42,;.72,-3.04,;.19,-4.5,;1.18,-5.68,;-1.32,-4.76,;-2.31,-3.59,;-3.83,-3.85,;-2.39,.53,;-1.03,1.25,;-.97,2.8,;-2.29,3.62,;-3.65,2.9,;-3.7,1.36,;-4.89,.36,;-8.22,-1.82,;-9.71,-2.21,;-7.74,-3.28,;-8.7,-.36,)|
Show InChI InChI=1S/C26H30F3N5/c1-5-11-32(14-19-8-9-19)15-21-23(26(27,28)29)31-25-33(21)20-7-6-10-30-24(20)34(25)22-17(3)12-16(2)13-18(22)4/h6-7,10,12-13,19H,5,8-9,11,14-15H2,1-4H3
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16n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203617
PNG
(CHEMBL395833 | cyclobutylmethyl-[2-ethyl-8-(2,4,6-...)
Show SMILES CCCN(CC1CCC1)Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(11.68,4.65,;10.16,4.38,;9.64,2.93,;8.12,2.66,;7.34,3.99,;5.8,3.97,;4.69,5.05,;3.62,3.94,;4.72,2.87,;7.6,1.22,;8.59,.04,;8.22,-1.46,;6.8,-2.04,;5.58,-1.09,;9.53,-2.27,;10.71,-1.28,;12.25,-1.17,;13.24,-2.35,;14.74,-2.08,;15.27,-.64,;15.73,-3.26,;15.21,-4.71,;16.2,-5.89,;13.69,-4.98,;12.7,-3.8,;11.18,-4.06,;12.62,.32,;13.99,1.04,;14.05,2.59,;12.73,3.41,;11.36,2.68,;11.31,1.14,;10.13,.15,)|
Show InChI InChI=1S/C28H37N5/c1-6-14-31(17-22-10-8-11-22)18-25-23(7-2)30-28-32(25)24-12-9-13-29-27(24)33(28)26-20(4)15-19(3)16-21(26)5/h9,12-13,15-16,22H,6-8,10-11,14,17-18H2,1-5H3
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17n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203597
PNG
(CHEMBL556060 | dibutyl-[8-(2-chloro-4,6-dimethyl-p...)
Show SMILES CCCCN(CCCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(3.39,-10.54,;2.87,-11.99,;1.35,-12.26,;.83,-13.7,;-.68,-13.98,;-1.67,-12.8,;-3.19,-13.07,;-4.18,-11.89,;-5.69,-12.16,;-1.21,-15.42,;-.22,-16.6,;-.58,-18.09,;-2.01,-18.67,;.72,-18.9,;1.9,-17.92,;3.44,-17.81,;4.42,-18.98,;5.93,-18.71,;6.45,-17.27,;6.92,-19.89,;6.39,-21.35,;7.39,-22.52,;4.88,-21.61,;3.89,-20.43,;2.38,-20.69,;3.81,-16.33,;5.17,-15.6,;5.24,-14.05,;3.92,-13.23,;2.56,-13.96,;2.5,-15.49,;1.32,-16.49,)|
Show InChI InChI=1S/C26H34ClN5/c1-6-8-13-30(14-9-7-2)17-23-20(5)29-26-31(23)22-11-10-12-28-25(22)32(26)24-19(4)15-18(3)16-21(24)27/h10-12,15-16H,6-9,13-14,17H2,1-5H3
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18n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203599
PNG
(CHEMBL247558 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCN(CC1CCC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(-10.49,-43.18,;-8.98,-42.91,;-7.99,-44.09,;-6.47,-43.82,;-5.95,-42.37,;-4.56,-41.72,;-5.21,-40.33,;-6.61,-40.98,;-8.51,-45.54,;-7.52,-46.72,;-7.89,-48.21,;-9.31,-48.79,;-6.58,-49.02,;-5.4,-48.04,;-3.86,-47.93,;-2.87,-49.11,;-1.37,-48.84,;-.84,-47.39,;-.38,-50.01,;-.9,-51.47,;.09,-52.65,;-2.42,-51.73,;-3.41,-50.55,;-4.92,-50.82,;-3.49,-46.44,;-2.12,-45.72,;-2.06,-44.17,;-3.38,-43.34,;-4.74,-44.07,;-4.8,-45.61,;-5.98,-46.6,)|
Show InChI InChI=1S/C25H30ClN5/c1-5-29(14-19-8-6-9-19)15-22-18(4)28-25-30(22)21-10-7-11-27-24(21)31(25)23-17(3)12-16(2)13-20(23)26/h7,10-13,19H,5-6,8-9,14-15H2,1-4H3
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20n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203594
PNG
(CHEMBL391169 | bis-cyclopropylmethyl-[2-methyl-8-(...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n2c1CN(CC1CC1)CC1CC1 |(19.36,-18.14,;20.79,-17.56,;22.1,-18.37,;23.28,-17.38,;24.81,-17.27,;25.8,-18.45,;27.31,-18.18,;27.83,-16.74,;28.3,-19.36,;27.78,-20.81,;28.77,-21.99,;26.26,-21.08,;25.27,-19.9,;23.75,-20.16,;25.19,-15.79,;26.56,-15.06,;26.61,-13.51,;25.29,-12.69,;23.93,-13.42,;23.88,-14.96,;22.7,-15.95,;21.16,-16.06,;20.17,-14.88,;20.69,-13.44,;22.21,-13.17,;22.73,-11.72,;23.9,-10.73,;22.45,-10.2,;19.7,-12.26,;18.18,-12.53,;16.74,-12.01,;17.01,-13.53,)|
Show InChI InChI=1S/C27H33N5/c1-17-12-18(2)25(19(3)13-17)32-26-23(6-5-11-28-26)31-24(20(4)29-27(31)32)16-30(14-21-7-8-21)15-22-9-10-22/h5-6,11-13,21-22H,7-10,14-16H2,1-4H3
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23n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203619
PNG
(CHEMBL430391 | diallyl-[2-methyl-8-(2,4,6-trimethy...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n2c1CN(CC=C)CC=C |(4.62,-18.05,;6.05,-17.47,;7.36,-18.28,;8.53,-17.3,;10.07,-17.19,;11.06,-18.37,;12.57,-18.1,;13.09,-16.65,;13.56,-19.27,;13.03,-20.73,;14.03,-21.91,;11.52,-20.99,;10.53,-19.81,;9.01,-20.08,;10.45,-15.7,;11.82,-14.98,;11.87,-13.43,;10.55,-12.61,;9.19,-13.33,;9.14,-14.87,;7.96,-15.87,;6.42,-15.98,;5.43,-14.8,;5.95,-13.35,;4.96,-12.17,;3.44,-12.44,;2.45,-11.27,;7.47,-13.08,;7.99,-11.63,;9.51,-11.36,)|
Show InChI InChI=1S/C25H29N5/c1-7-12-28(13-8-2)16-22-20(6)27-25-29(22)21-10-9-11-26-24(21)30(25)23-18(4)14-17(3)15-19(23)5/h7-11,14-15H,1-2,12-13,16H2,3-6H3
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26n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203602
PNG
(CHEMBL247358 | diallyl-[8-(2-chloro-4,6-dimethyl-p...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN(CC=C)CC=C |(-8.91,-17.58,;-7.48,-17,;-6.18,-17.81,;-5,-16.83,;-3.46,-16.72,;-2.47,-17.9,;-.96,-17.63,;-.44,-16.18,;.03,-18.8,;-.5,-20.26,;.49,-21.44,;-2.02,-20.52,;-3.01,-19.34,;-4.52,-19.61,;-3.09,-15.23,;-1.72,-14.51,;-1.66,-12.96,;-2.98,-12.14,;-4.34,-12.86,;-4.4,-14.4,;-5.58,-15.4,;-7.11,-15.51,;-8.11,-14.33,;-7.58,-12.88,;-8.58,-11.7,;-10.09,-11.97,;-11.08,-10.8,;-6.07,-12.61,;-5.54,-11.16,;-4.03,-10.89,)|
Show InChI InChI=1S/C24H26ClN5/c1-6-11-28(12-7-2)15-21-18(5)27-24-29(21)20-9-8-10-26-23(20)30(24)22-17(4)13-16(3)14-19(22)25/h6-10,13-14H,1-2,11-12,15H2,3-5H3
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28n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203600
PNG
(CHEMBL246944 | benzyl-[8-(2-chloro-4,6-dimethyl-ph...)
Show SMILES CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)Cc1ccccc1 |(29.67,-32.19,;30.67,-33.37,;32.18,-33.1,;33.17,-34.28,;32.65,-35.73,;33.64,-36.9,;33.27,-38.4,;31.85,-38.98,;34.58,-39.21,;35.76,-38.22,;37.3,-38.11,;38.29,-39.29,;39.79,-39.03,;40.32,-37.58,;40.78,-40.2,;40.26,-41.65,;41.25,-42.83,;38.74,-41.92,;37.75,-40.74,;36.23,-41,;37.67,-36.63,;39.04,-35.9,;39.1,-34.36,;37.78,-33.53,;36.41,-34.26,;36.36,-35.8,;35.18,-36.79,;34.69,-34.01,;35.21,-32.56,;36.73,-32.29,;37.25,-30.85,;36.26,-29.67,;34.73,-29.94,;34.22,-31.39,)|
Show InChI InChI=1S/C28H30ClN5/c1-5-14-32(17-22-10-7-6-8-11-22)18-25-21(4)31-28-33(25)24-12-9-13-30-27(24)34(28)26-20(3)15-19(2)16-23(26)29/h6-13,15-16H,5,14,17-18H2,1-4H3
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28n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203588
PNG
(CHEMBL392654 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCN(CC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(17.67,-28.23,;19.19,-27.96,;20.18,-29.14,;21.69,-28.87,;22.22,-27.42,;23.39,-26.43,;21.94,-25.9,;19.66,-30.58,;20.65,-31.76,;20.28,-33.26,;18.85,-33.84,;21.59,-34.07,;22.76,-33.08,;24.3,-32.97,;25.29,-34.15,;26.8,-33.88,;27.32,-32.44,;27.79,-35.06,;27.26,-36.51,;28.25,-37.69,;25.74,-36.78,;24.76,-35.6,;23.24,-35.86,;24.68,-31.49,;26.04,-30.76,;26.1,-29.22,;24.78,-28.39,;23.42,-29.12,;23.37,-30.66,;22.18,-31.65,)|
Show InChI InChI=1S/C24H28ClN5/c1-5-28(13-18-8-9-18)14-21-17(4)27-24-29(21)20-7-6-10-26-23(20)30(24)22-16(3)11-15(2)12-19(22)25/h6-7,10-12,18H,5,8-9,13-14H2,1-4H3
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36n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203606
PNG
(CHEMBL247755 | butyl-[8-(2-chloro-4,6-dimethyl-phe...)
Show SMILES CCCCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(38.38,-42.11,;37.86,-43.56,;36.34,-43.83,;35.82,-45.28,;34.3,-45.55,;33.31,-44.37,;31.79,-44.64,;33.78,-46.99,;34.77,-48.17,;34.4,-49.67,;32.98,-50.25,;35.71,-50.48,;36.89,-49.49,;38.43,-49.38,;39.42,-50.56,;40.92,-50.29,;41.45,-48.84,;41.91,-51.47,;41.39,-52.92,;42.38,-54.1,;39.87,-53.19,;38.88,-52.01,;37.36,-52.27,;38.8,-47.89,;40.17,-47.17,;40.23,-45.62,;38.85,-44.73,;37.54,-45.53,;37.49,-47.07,;36.31,-48.06,)|
Show InChI InChI=1S/C24H30ClN5/c1-6-8-12-28(7-2)15-21-18(5)27-24-29(21)20-10-9-11-26-23(20)30(24)22-17(4)13-16(3)14-19(22)25/h9-11,13-14H,6-8,12,15H2,1-5H3
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36n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203604
PNG
(CHEMBL247152 | allyl-[2-methyl-8-(2,4,6-trimethyl-...)
Show SMILES CCCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(2.74,3.94,;3.73,2.76,;5.25,3.03,;6.24,1.85,;7.76,2.12,;8.28,3.57,;9.8,3.84,;5.72,.4,;6.71,-.77,;6.34,-2.27,;4.91,-2.85,;7.65,-3.08,;8.83,-2.09,;10.36,-1.99,;11.35,-3.17,;12.86,-2.9,;13.38,-1.45,;13.85,-4.07,;13.33,-5.53,;14.32,-6.7,;11.81,-5.79,;10.82,-4.61,;9.3,-4.87,;10.74,-.5,;12.11,.22,;12.16,1.77,;10.84,2.6,;9.48,1.87,;9.43,.33,;8.25,-.66,)|
Show InChI InChI=1S/C25H31N5/c1-7-12-28(13-8-2)16-22-20(6)27-25-29(22)21-10-9-11-26-24(21)30(25)23-18(4)14-17(3)15-19(23)5/h7,9-11,14-15H,1,8,12-13,16H2,2-6H3
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41n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203612
PNG
((2-cyclopropyl-ethyl)-[2-methyl-8-(2,4,6-trimethyl...)
Show SMILES CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(-12.12,-26.35,;-11.13,-27.53,;-9.61,-27.26,;-8.62,-28.43,;-7.1,-28.16,;-6.58,-26.71,;-5.06,-26.44,;-3.62,-26.97,;-3.89,-25.45,;-9.14,-29.88,;-8.15,-31.06,;-8.52,-32.55,;-9.95,-33.13,;-7.21,-33.37,;-6.03,-32.38,;-4.5,-32.27,;-3.51,-33.45,;-2,-33.18,;-1.48,-31.73,;-1.01,-34.35,;-1.53,-35.81,;-.54,-36.99,;-3.05,-36.08,;-4.04,-34.9,;-5.56,-35.16,;-4.12,-30.78,;-2.75,-30.06,;-2.7,-28.51,;-4.02,-27.69,;-5.38,-28.42,;-5.43,-29.96,;-6.61,-30.95,)|
Show InChI InChI=1S/C27H35N5/c1-6-13-30(14-11-22-9-10-22)17-24-21(5)29-27-31(24)23-8-7-12-28-26(23)32(27)25-19(3)15-18(2)16-20(25)4/h7-8,12,15-16,22H,6,9-11,13-14,17H2,1-5H3
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43n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203615
PNG
(3-(2-benzyl-pyrrolidin-1-ylmethyl)-8-(2-chloro-4,6...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCCC1Cc1ccccc1 |w:27.32,(21.49,-4.05,;22.92,-3.48,;24.23,-4.29,;25.41,-3.3,;26.95,-3.19,;27.94,-4.37,;29.44,-4.1,;29.97,-2.65,;30.43,-5.28,;29.91,-6.73,;30.9,-7.91,;28.39,-7,;27.4,-5.82,;25.88,-6.08,;27.32,-1.7,;28.69,-.98,;28.75,.57,;27.37,1.46,;26.06,.66,;26.01,-.88,;24.83,-1.87,;23.29,-1.98,;22.3,-.8,;22.82,.64,;24.3,1.07,;24.35,2.61,;22.9,3.13,;21.96,1.91,;20.42,1.96,;19.69,3.32,;20.5,4.63,;19.78,5.98,;18.24,6.03,;17.43,4.71,;18.16,3.36,)|
Show InChI InChI=1S/C29H30ClN5/c1-19-15-20(2)27(24(30)16-19)35-28-25(12-7-13-31-28)34-26(21(3)32-29(34)35)18-33-14-8-11-23(33)17-22-9-5-4-6-10-22/h4-7,9-10,12-13,15-16,23H,8,11,14,17-18H2,1-3H3
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48n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203614
PNG
(CHEMBL247753 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(2.87,-43.39,;4.38,-43.12,;5.38,-44.29,;6.89,-44.02,;7.42,-42.58,;8.93,-42.3,;10.38,-42.83,;10.11,-41.31,;4.85,-45.74,;5.85,-46.92,;5.48,-48.41,;4.05,-48.99,;6.78,-49.23,;7.96,-48.24,;9.5,-48.13,;10.49,-49.31,;12,-49.04,;12.52,-47.59,;12.99,-50.22,;12.46,-51.67,;13.45,-52.85,;10.94,-51.94,;9.96,-50.76,;8.44,-51.02,;9.87,-46.64,;11.24,-45.92,;11.3,-44.37,;9.98,-43.55,;8.62,-44.28,;8.56,-45.82,;7.38,-46.81,)|
Show InChI InChI=1S/C25H30ClN5/c1-5-29(12-10-19-8-9-19)15-22-18(4)28-25-30(22)21-7-6-11-27-24(21)31(25)23-17(3)13-16(2)14-20(23)26/h6-7,11,13-14,19H,5,8-10,12,15H2,1-4H3
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50n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203605
PNG
(CHEMBL428048 | cyclopropylmethyl-ethyl-[2-methyl-8...)
Show SMILES CCN(CC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 |(30.5,-28.02,;32.01,-27.75,;33,-28.92,;34.52,-28.65,;35.04,-27.2,;36.21,-26.21,;34.76,-25.69,;32.48,-30.37,;33.47,-31.55,;33.1,-33.04,;31.68,-33.62,;34.41,-33.86,;35.59,-32.87,;37.13,-32.76,;38.12,-33.94,;39.62,-33.67,;40.15,-32.22,;40.61,-34.84,;40.09,-36.3,;41.08,-37.48,;38.57,-36.57,;37.58,-35.39,;36.07,-35.65,;37.5,-31.27,;38.87,-30.55,;38.93,-29,;37.61,-28.18,;36.25,-28.91,;36.19,-30.45,;35.01,-31.44,)|
Show InChI InChI=1S/C25H31N5/c1-6-28(14-20-9-10-20)15-22-19(5)27-25-29(22)21-8-7-11-26-24(21)30(25)23-17(3)12-16(2)13-18(23)4/h7-8,11-13,20H,6,9-10,14-15H2,1-5H3
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93n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203596
PNG
(CHEMBL247957 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(-5.9,3.18,;-6.5,1.76,;-8.03,1.57,;-8.9,2.84,;-10.43,2.72,;-8.55,.12,;-7.56,-1.06,;-7.93,-2.55,;-9.36,-3.13,;-6.62,-3.36,;-5.44,-2.38,;-3.91,-2.27,;-2.92,-3.45,;-1.41,-3.18,;-.89,-1.73,;-.42,-4.35,;-.94,-5.81,;.05,-6.99,;-2.46,-6.07,;-3.45,-4.89,;-4.97,-5.16,;-3.53,-.78,;-2.16,-.06,;-2.11,1.49,;-3.48,2.38,;-4.79,1.59,;-4.84,.05,;-6.02,-.95,)|
Show InChI InChI=1S/C22H26ClN5/c1-6-26(7-2)13-19-16(5)25-22-27(19)18-9-8-10-24-21(18)28(22)20-15(4)11-14(3)12-17(20)23/h8-12H,6-7,13H2,1-5H3
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360n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203613
PNG
(CHEMBL245297 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(CCc1cccnc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(-9.05,.26,;-8.05,-.9,;-6.54,-.64,;-6.01,.8,;-7,1.99,;-8.51,1.71,;-9.49,2.89,;-8.96,4.34,;-7.44,4.61,;-6.46,3.42,;-8.58,-2.35,;-7.59,-3.53,;-7.96,-5.02,;-9.38,-5.6,;-6.65,-5.84,;-5.47,-4.85,;-3.93,-4.74,;-2.94,-5.92,;-1.44,-5.65,;-.91,-4.2,;-.44,-6.82,;-.97,-8.28,;.02,-9.46,;-2.49,-8.55,;-3.48,-7.37,;-4.99,-7.63,;-3.56,-3.25,;-2.19,-2.53,;-2.13,-.98,;-3.51,-.09,;-4.81,-.89,;-4.87,-2.43,;-6.05,-3.42,)|
Show InChI InChI=1S/C26H27ClN6/c1-17-13-18(2)24(21(27)14-17)33-25-22(8-6-11-29-25)32-23(19(3)30-26(32)33)16-31(4)12-9-20-7-5-10-28-15-20/h5-8,10-11,13-15H,9,12,16H2,1-4H3
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570n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203622
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-(2-phe...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCCC1c1ccccc1 |w:27.32,(37.46,-4.03,;38.89,-3.45,;40.2,-4.26,;41.38,-3.28,;42.92,-3.17,;43.9,-4.35,;45.41,-4.08,;45.93,-2.63,;46.4,-5.25,;45.88,-6.71,;46.87,-7.89,;44.36,-6.97,;43.37,-5.79,;41.85,-6.06,;43.29,-1.68,;44.66,-.96,;44.72,.59,;43.34,1.48,;42.03,.69,;41.98,-.85,;40.8,-1.84,;39.26,-1.95,;38.27,-.78,;38.79,.67,;40.27,1.09,;40.32,2.63,;38.87,3.16,;37.92,1.94,;36.39,1.99,;35.66,3.35,;34.13,3.39,;33.31,2.08,;34.05,.72,;35.59,.68,)|
Show InChI InChI=1S/C28H28ClN5/c1-18-15-19(2)26(22(29)16-18)34-27-24(11-7-13-30-27)33-25(20(3)31-28(33)34)17-32-14-8-12-23(32)21-9-5-4-6-10-21/h4-7,9-11,13,15-16,23H,8,12,14,17H2,1-3H3
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580n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203616
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-(3-phe...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCC(CCc2ccccc2)C1 |w:26.30,(7.31,-23,;8.74,-22.42,;10.04,-23.23,;11.22,-22.24,;12.76,-22.13,;13.75,-23.32,;15.26,-23.05,;15.78,-21.6,;16.25,-24.22,;15.72,-25.68,;16.71,-26.85,;14.2,-25.94,;13.22,-24.76,;11.7,-25.02,;13.14,-20.65,;14.5,-19.92,;14.56,-18.38,;13.19,-17.49,;11.88,-18.28,;11.82,-19.82,;10.64,-20.81,;9.11,-20.92,;8.11,-19.75,;8.64,-18.3,;10.11,-17.88,;10.16,-16.34,;8.72,-15.81,;8.29,-14.33,;6.79,-13.96,;6.36,-12.49,;7.43,-11.38,;7.01,-9.9,;5.51,-9.53,;4.44,-10.65,;4.87,-12.12,;7.77,-17.03,)|
Show InChI InChI=1S/C30H32ClN5/c1-20-16-21(2)28(25(31)17-20)36-29-26(10-7-14-32-29)35-27(22(3)33-30(35)36)19-34-15-13-24(18-34)12-11-23-8-5-4-6-9-23/h4-10,14,16-17,24H,11-13,15,18-19H2,1-3H3
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700n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203592
PNG
(3-(3-benzyl-pyrrolidin-1-ylmethyl)-8-(2-chloro-4,6...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCC(Cc2ccccc2)C1 |w:26.30,(9.32,-16.47,;10.75,-15.89,;12.05,-16.7,;13.23,-15.71,;14.77,-15.61,;15.76,-16.79,;17.27,-16.52,;17.79,-15.07,;18.26,-17.69,;17.73,-19.15,;18.72,-20.33,;16.21,-19.41,;15.23,-18.23,;13.71,-18.5,;15.15,-14.12,;16.51,-13.4,;16.57,-11.85,;15.2,-10.96,;13.89,-11.75,;13.83,-13.29,;12.65,-14.28,;11.12,-14.39,;10.12,-13.22,;10.65,-11.77,;12.12,-11.35,;12.17,-9.81,;10.73,-9.28,;10.3,-7.81,;8.8,-7.44,;8.38,-5.96,;6.89,-5.59,;5.82,-6.7,;6.25,-8.18,;7.74,-8.54,;9.78,-10.5,)|
Show InChI InChI=1S/C29H30ClN5/c1-19-14-20(2)27(24(30)15-19)35-28-25(10-7-12-31-28)34-26(21(3)32-29(34)35)18-33-13-11-23(17-33)16-22-8-5-4-6-9-22/h4-10,12,14-15,23H,11,13,16-18H2,1-3H3
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700n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203627
PNG
(CHEMBL392044 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)Cc1ccncc1 |(4.83,-35.64,;5.82,-36.8,;5.3,-38.25,;6.29,-39.43,;5.92,-40.92,;4.49,-41.5,;7.23,-41.74,;8.41,-40.75,;9.95,-40.64,;10.94,-41.82,;12.44,-41.55,;12.96,-40.1,;13.43,-42.73,;12.91,-44.18,;13.9,-45.36,;11.39,-44.45,;10.4,-43.27,;8.88,-43.53,;10.32,-39.15,;11.69,-38.43,;11.75,-36.88,;10.37,-35.99,;9.06,-36.79,;9.01,-38.33,;7.83,-39.32,;7.34,-36.54,;7.87,-35.1,;9.39,-34.84,;9.92,-33.4,;8.93,-32.21,;7.41,-32.48,;6.88,-33.93,)|
Show InChI InChI=1S/C25H25ClN6/c1-16-12-17(2)23(20(26)13-16)32-24-21(6-5-9-28-24)31-22(18(3)29-25(31)32)15-30(4)14-19-7-10-27-11-8-19/h5-13H,14-15H2,1-4H3
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1.20E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203607
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-(2-phe...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCCC1CCc1ccccc1 |w:27.32,(24.88,-21.33,;26.31,-20.75,;27.62,-21.56,;28.8,-20.57,;30.33,-20.47,;31.32,-21.65,;32.83,-21.38,;33.35,-19.93,;33.82,-22.55,;33.3,-24.01,;34.29,-25.19,;31.78,-24.27,;30.79,-23.09,;29.27,-23.36,;30.71,-18.98,;32.08,-18.26,;32.14,-16.71,;30.76,-15.82,;29.45,-16.61,;29.4,-18.15,;28.22,-19.14,;26.68,-19.25,;25.69,-18.08,;26.21,-16.63,;27.69,-16.21,;27.74,-14.67,;26.29,-14.15,;25.34,-15.36,;23.8,-15.31,;23.08,-13.96,;21.54,-13.91,;20.82,-12.55,;19.28,-12.5,;18.47,-13.81,;19.2,-15.17,;20.74,-15.21,)|
Show InChI InChI=1S/C30H32ClN5/c1-20-17-21(2)28(25(31)18-20)36-29-26(12-7-15-32-29)35-27(22(3)33-30(35)36)19-34-16-8-11-24(34)14-13-23-9-5-4-6-10-23/h4-7,9-10,12,15,17-18,24H,8,11,13-14,16,19H2,1-3H3
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1.30E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203620
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-morpho...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCOCC1 |(-8.79,-40.1,;-7.37,-39.52,;-6.06,-40.33,;-4.88,-39.35,;-3.34,-39.24,;-2.35,-40.42,;-.84,-40.15,;-.32,-38.7,;.15,-41.32,;-.38,-42.78,;.61,-43.96,;-1.9,-43.04,;-2.89,-41.86,;-4.4,-42.13,;-2.97,-37.75,;-1.6,-37.03,;-1.54,-35.48,;-2.92,-34.59,;-4.22,-35.38,;-4.28,-36.92,;-5.46,-37.91,;-7,-38.03,;-7.99,-36.85,;-7.46,-35.4,;-5.95,-35.14,;-5.43,-33.7,;-6.41,-32.52,;-7.93,-32.78,;-8.46,-34.23,)|
Show InChI InChI=1S/C22H24ClN5O/c1-14-11-15(2)20(17(23)12-14)28-21-18(5-4-6-24-21)27-19(16(3)25-22(27)28)13-26-7-9-29-10-8-26/h4-6,11-12H,7-10,13H2,1-3H3
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1.40E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203593
PNG
(CHEMBL248367 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)Cc1cccnc1 |(19,-35.87,;20,-37.03,;19.48,-38.48,;20.47,-39.66,;20.1,-41.15,;18.67,-41.73,;21.41,-41.97,;22.58,-40.98,;24.12,-40.87,;25.11,-42.05,;26.62,-41.78,;27.14,-40.33,;27.61,-42.95,;27.08,-44.41,;28.07,-45.59,;25.56,-44.68,;24.58,-43.5,;23.06,-43.76,;24.5,-39.38,;25.86,-38.66,;25.92,-37.11,;24.55,-36.22,;23.24,-37.01,;23.19,-38.56,;22,-39.55,;21.51,-36.77,;22.04,-35.33,;23.56,-35.07,;24.09,-33.63,;23.11,-32.44,;21.58,-32.71,;21.06,-34.16,)|
Show InChI InChI=1S/C25H25ClN6/c1-16-11-17(2)23(20(26)12-16)32-24-21(8-6-10-28-24)31-22(18(3)29-25(31)32)15-30(4)14-19-7-5-9-27-13-19/h5-13H,14-15H2,1-4H3
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2.70E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203591
PNG
(CHEMBL396821 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(CCc1ccccn1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(5.34,.35,;6.34,-.82,;7.85,-.56,;8.38,.89,;7.39,2.07,;5.89,1.8,;4.9,2.98,;5.43,4.43,;6.95,4.69,;7.93,3.51,;5.81,-2.27,;6.8,-3.44,;6.43,-4.94,;5.01,-5.52,;7.74,-5.75,;8.92,-4.76,;10.46,-4.65,;11.45,-5.84,;12.96,-5.57,;13.48,-4.12,;13.95,-6.74,;13.42,-8.2,;14.41,-9.37,;11.9,-8.46,;10.91,-7.28,;9.4,-7.54,;10.83,-3.17,;12.2,-2.44,;12.26,-.9,;10.88,-.01,;9.58,-.8,;9.52,-2.34,;8.34,-3.33,)|
Show InChI InChI=1S/C26H27ClN6/c1-17-14-18(2)24(21(27)15-17)33-25-22(9-7-12-29-25)32-23(19(3)30-26(32)33)16-31(4)13-10-20-8-5-6-11-28-20/h5-9,11-12,14-15H,10,13,16H2,1-4H3
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2.80E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203623
PNG
(CHEMBL396822 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CCCC(C)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |w:3.3,(-7.02,-13.67,;-5.56,-14.16,;-5.25,-15.67,;-3.8,-16.16,;-2.64,-15.14,;-3.49,-17.67,;-4.3,-18.98,;-3.57,-20.34,;-4.24,-21.73,;-5.76,-22,;-3.14,-22.79,;-1.78,-22.07,;-.25,-22.29,;.47,-23.65,;2,-23.7,;2.81,-22.39,;2.73,-25.05,;1.91,-26.36,;2.63,-27.72,;.37,-26.31,;-.35,-24.95,;-1.89,-24.89,;.43,-20.91,;1.91,-20.49,;2.29,-18.98,;1.13,-17.83,;-.31,-18.33,;-.68,-19.83,;-2.05,-20.55,)|
Show InChI InChI=1S/C23H28ClN5/c1-6-8-16(4)26-13-20-17(5)27-23-28(20)19-9-7-10-25-22(19)29(23)21-15(3)11-14(2)12-18(21)24/h7,9-12,16,26H,6,8,13H2,1-5H3
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2.90E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203603
PNG
(CHEMBL428044 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(CCc1ccncc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(17.91,.48,;18.9,-.69,;20.42,-.43,;20.95,1.02,;19.96,2.2,;20.5,3.64,;19.51,4.82,;18,4.56,;17.47,3.1,;18.45,1.93,;18.38,-2.14,;19.37,-3.32,;19,-4.81,;17.58,-5.39,;20.31,-5.62,;21.49,-4.64,;23.03,-4.53,;24.02,-5.71,;25.52,-5.44,;26.05,-3.99,;26.51,-6.61,;25.99,-8.07,;26.98,-9.25,;24.47,-8.33,;23.48,-7.15,;21.97,-7.42,;23.4,-3.04,;24.77,-2.32,;24.83,-.77,;23.45,.12,;22.15,-.67,;22.09,-2.21,;20.91,-3.2,)|
Show InChI InChI=1S/C26H27ClN6/c1-17-14-18(2)24(21(27)15-17)33-25-22(6-5-10-29-25)32-23(19(3)30-26(32)33)16-31(4)13-9-20-7-11-28-12-8-20/h5-8,10-12,14-15H,9,13,16H2,1-4H3
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3.20E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203601
PNG
(CHEMBL245298 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES COCCN(CCOC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(34.7,2.75,;34.18,1.3,;32.67,1.02,;32.15,-.43,;30.63,-.71,;29.64,.46,;30.15,1.91,;29.15,3.08,;29.66,4.53,;30.11,-2.15,;31.1,-3.33,;30.73,-4.83,;29.31,-5.41,;32.04,-5.64,;33.22,-4.65,;34.76,-4.54,;35.75,-5.72,;37.25,-5.45,;37.78,-4.01,;38.24,-6.63,;37.72,-8.08,;38.71,-9.26,;36.2,-8.35,;35.21,-7.17,;33.69,-7.43,;35.13,-3.06,;36.5,-2.33,;36.56,-.78,;35.18,.1,;33.87,-.69,;33.82,-2.23,;32.64,-3.22,)|
Show InChI InChI=1S/C24H30ClN5O2/c1-16-13-17(2)22(19(25)14-16)30-23-20(7-6-8-26-23)29-21(18(3)27-24(29)30)15-28(9-11-31-4)10-12-32-5/h6-8,13-14H,9-12,15H2,1-5H3
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4.10E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203595
PNG
(CHEMBL245506 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES COCC(COC)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 |(14.24,-12.4,;13.71,-13.85,;14.7,-15.03,;14.18,-16.48,;12.66,-16.75,;11.67,-15.57,;10.16,-15.84,;15.17,-17.66,;14.65,-19.1,;15.64,-20.28,;15.27,-21.78,;13.85,-22.35,;16.58,-22.59,;17.76,-21.6,;19.3,-21.49,;20.29,-22.67,;21.79,-22.4,;22.32,-20.95,;22.78,-23.58,;22.26,-25.03,;23.25,-26.21,;20.74,-25.3,;19.75,-24.12,;18.23,-24.38,;19.67,-20,;21.04,-19.28,;21.1,-17.73,;19.72,-16.84,;18.41,-17.64,;18.36,-19.18,;17.18,-20.17,)|
Show InChI InChI=1S/C23H28ClN5O2/c1-14-9-15(2)21(18(24)10-14)29-22-19(7-6-8-25-22)28-20(16(3)27-23(28)29)11-26-17(12-30-4)13-31-5/h6-10,17,26H,11-13H2,1-5H3
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5.60E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50203618
PNG
(CHEMBL248368 | [8-(2-chloro-4,6-dimethyl-phenyl)-2...)
Show SMILES CN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)Cc1ccccn1 |(33.71,-35.43,;34.71,-36.6,;34.18,-38.04,;35.17,-39.22,;34.8,-40.72,;33.38,-41.3,;36.11,-41.53,;37.29,-40.54,;38.83,-40.43,;39.82,-41.61,;41.32,-41.34,;41.85,-39.9,;42.32,-42.52,;41.79,-43.97,;42.78,-45.15,;40.27,-44.24,;39.28,-43.06,;37.77,-43.32,;39.2,-38.95,;40.57,-38.22,;40.63,-36.67,;39.25,-35.78,;37.95,-36.58,;37.89,-38.12,;36.71,-39.11,;36.22,-36.34,;36.75,-34.89,;38.27,-34.64,;38.8,-33.19,;37.81,-32.01,;36.29,-32.28,;35.77,-33.72,)|
Show InChI InChI=1S/C25H25ClN6/c1-16-12-17(2)23(20(26)13-16)32-24-21(9-7-11-28-24)31-22(18(3)29-25(31)32)15-30(4)14-19-8-5-6-10-27-19/h5-13H,14-15H2,1-4H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production


Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair