Found 41 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394516
(CHEMBL2160157)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(Cl)cc(COC)cc1OC |(3.38,8.07,;2.04,7.32,;2.01,5.78,;3.33,4.99,;4.69,5.72,;.67,5.04,;-.65,5.83,;-2,5.08,;-2.02,3.54,;-3.37,2.79,;-4.69,3.58,;-.7,2.75,;-.73,1.21,;.6,.42,;1.94,1.17,;3.26,.37,;1.96,2.7,;.64,3.5,;.57,-1.12,;1.89,-1.91,;3.24,-1.17,;1.87,-3.45,;.52,-4.2,;.5,-5.74,;1.82,-6.53,;1.8,-8.07,;-.8,-3.41,;-.77,-1.87,;-2.1,-1.08,;-3.44,-1.83,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-9-10-20(29-5)24-17(19)11-15(3)23(26-24)22-18(25)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389532
(CHEMBL2063375)Show SMILES CCN(CCOC)c1ccc(C)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(47.84,-10.28,;49.18,-11.04,;49.18,-12.58,;50.52,-13.35,;50.52,-14.89,;51.86,-15.65,;51.87,-17.19,;47.85,-13.36,;46.52,-12.59,;45.19,-13.36,;45.18,-14.91,;43.85,-15.68,;46.52,-15.67,;46.51,-17.21,;47.85,-17.99,;49.19,-17.21,;50.52,-17.98,;49.19,-15.67,;47.86,-14.91,;47.85,-19.52,;46.51,-20.29,;45.18,-19.52,;43.85,-20.29,;46.51,-21.83,;47.85,-22.6,;47.85,-24.14,;46.52,-24.91,;45.18,-24.14,;49.19,-21.82,;49.18,-20.29,;50.51,-19.51,;51.85,-20.28,)| Show InChI InChI=1S/C26H34N2O4/c1-8-28(11-12-29-4)21-10-9-17(2)25-20(21)13-18(3)26(27-25)24-22(31-6)14-19(16-30-5)15-23(24)32-7/h9-10,13-15H,8,11-12,16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394527
(CHEMBL2160161)Show SMILES CCN(CC)c1ccc(Cl)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.04,5.73,;2.69,4.99,;1.36,5.77,;1.38,7.31,;2.72,8.07,;.02,5.01,;-1.3,5.79,;-2.64,5.03,;-2.66,3.49,;-4,2.74,;-1.33,2.71,;-1.34,1.17,;-.02,.39,;1.32,1.15,;2.65,.37,;1.34,2.69,;.01,3.47,;-.03,-1.15,;-1.37,-1.91,;-2.7,-1.13,;-4.04,-1.88,;-1.39,-3.45,;-.06,-4.23,;-.07,-5.77,;-1.41,-6.53,;-1.43,-8.07,;1.28,-3.47,;1.3,-1.93,;2.64,-1.17,;3.96,-1.95,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-10-9-18(25)24-17(19)11-15(3)23(26-24)22-20(29-5)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394520
(CHEMBL2160170)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(CC)cc12)-c1c(OC)cc(COC)cc1OC |(4.67,5.76,;3.33,5,;2,5.77,;2.01,7.31,;3.35,8.08,;.67,5.01,;-.66,5.78,;-2,5.02,;-2.01,3.48,;-3.34,2.71,;-4.67,3.49,;-.68,2.7,;-.68,1.16,;.65,.39,;1.98,1.15,;3.32,.38,;4.65,1.15,;1.99,2.69,;.66,3.47,;.64,-1.15,;-.69,-1.92,;-2.03,-1.14,;-3.36,-1.91,;-.7,-3.46,;.63,-4.23,;.62,-5.77,;-.71,-6.54,;-.72,-8.08,;1.97,-3.47,;1.97,-1.93,;3.31,-1.16,;4.64,-1.94,)| Show InChI InChI=1S/C26H34N2O4/c1-8-18-15-19-20(28(9-2)10-3)11-12-21(30-5)26(19)27-25(18)24-22(31-6)13-17(16-29-4)14-23(24)32-7/h11-15H,8-10,16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394525
(CHEMBL2160164)Show SMILES CCN(CC)c1ccc(C#N)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.59,5.83,;3.28,5.03,;1.94,5.78,;1.92,7.32,;3.25,8.11,;.61,5,;-.73,5.75,;-2.05,4.97,;-2.04,3.43,;-3.36,2.65,;-4.69,1.86,;-.7,2.67,;-.68,1.13,;.66,.38,;1.99,1.16,;3.33,.41,;1.97,2.7,;.63,3.46,;.68,-1.16,;-.65,-1.95,;-1.99,-1.19,;-3.31,-1.97,;-.63,-3.49,;.71,-4.24,;.73,-5.78,;-.6,-6.57,;-.58,-8.11,;2.04,-3.46,;2.02,-1.92,;3.35,-1.13,;4.69,-1.89,)| Show InChI InChI=1S/C25H29N3O3/c1-7-28(8-2)20-10-9-18(14-26)25-19(20)11-16(3)24(27-25)23-21(30-5)12-17(15-29-4)13-22(23)31-6/h9-13H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394514
(CHEMBL2160159)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(C)cc1OC |(3.3,6.94,;1.97,6.16,;1.98,4.62,;3.32,3.86,;4.55,4.53,;.65,3.84,;-.69,4.61,;-2.02,3.83,;-2.01,2.29,;-3.34,1.52,;-4.68,2.28,;-.67,1.53,;-.67,-.01,;.67,-.78,;2,,;3.34,-.76,;1.99,1.54,;.66,2.3,;.67,-2.32,;-.66,-3.09,;-1.99,-2.33,;-3.32,-3.1,;-.65,-4.63,;.69,-5.4,;.69,-6.94,;2.02,-4.62,;2.01,-3.08,;3.34,-2.3,;4.68,-3.07,)| Show InChI InChI=1S/C24H30N2O3/c1-8-26(9-2)18-10-11-19(27-5)24-17(18)14-16(4)23(25-24)22-20(28-6)12-15(3)13-21(22)29-7/h10-14H,8-9H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389539
(CHEMBL2063382)Show SMILES CCN(CC)c1ccc(C)c2nc(c(Cl)cc12)-c1c(OC)cc(COC)cc1OC |(62.06,-27.68,;63.4,-28.45,;63.41,-29.99,;64.74,-30.75,;64.75,-32.29,;62.08,-30.76,;60.74,-30,;59.41,-30.77,;59.41,-32.31,;58.08,-33.08,;60.74,-33.08,;60.74,-34.62,;62.07,-35.39,;63.41,-34.62,;64.75,-35.38,;63.41,-33.08,;62.08,-32.31,;62.08,-36.93,;60.74,-37.7,;59.41,-36.93,;58.07,-37.7,;60.74,-39.24,;62.07,-40.01,;62.08,-41.55,;60.74,-42.32,;59.41,-41.55,;63.41,-39.23,;63.41,-37.69,;64.74,-36.92,;66.07,-37.69,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-10-9-15(3)23-17(19)13-18(25)24(26-23)22-20(29-5)11-16(14-28-4)12-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394521
(CHEMBL2160169)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(Cl)cc12)-c1c(OC)cc(COC)cc1OC |(4.67,5.76,;3.33,5,;2,5.77,;2.01,7.31,;3.35,8.08,;.67,5.01,;-.66,5.78,;-2,5.02,;-2.01,3.48,;-3.34,2.71,;-4.67,3.49,;-.68,2.7,;-.68,1.16,;.65,.39,;1.98,1.15,;3.32,.38,;1.99,2.69,;.66,3.47,;.64,-1.15,;-.69,-1.92,;-2.03,-1.14,;-3.36,-1.91,;-.7,-3.46,;.63,-4.23,;.62,-5.77,;-.71,-6.54,;-.72,-8.08,;1.97,-3.47,;1.97,-1.93,;3.31,-1.16,;4.64,-1.94,)| Show InChI InChI=1S/C24H29ClN2O4/c1-7-27(8-2)18-9-10-19(29-4)23-16(18)13-17(25)24(26-23)22-20(30-5)11-15(14-28-3)12-21(22)31-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394527
(CHEMBL2160161)Show SMILES CCN(CC)c1ccc(Cl)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.04,5.73,;2.69,4.99,;1.36,5.77,;1.38,7.31,;2.72,8.07,;.02,5.01,;-1.3,5.79,;-2.64,5.03,;-2.66,3.49,;-4,2.74,;-1.33,2.71,;-1.34,1.17,;-.02,.39,;1.32,1.15,;2.65,.37,;1.34,2.69,;.01,3.47,;-.03,-1.15,;-1.37,-1.91,;-2.7,-1.13,;-4.04,-1.88,;-1.39,-3.45,;-.06,-4.23,;-.07,-5.77,;-1.41,-6.53,;-1.43,-8.07,;1.28,-3.47,;1.3,-1.93,;2.64,-1.17,;3.96,-1.95,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-10-9-18(25)24-17(19)11-15(3)23(26-24)22-20(29-5)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 62 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394515
(CHEMBL2160158)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(cc1OC)C#N |(3.34,3.08,;3.34,4.62,;2.01,5.39,;2.01,6.93,;3.34,7.7,;.67,4.62,;-.66,5.39,;-2,4.62,;-2,3.08,;-3.33,2.32,;-4.67,3.09,;-.67,2.31,;-.67,.77,;.67,0,;2,.77,;3.33,-0,;2,2.31,;.67,3.08,;.67,-1.54,;2,-2.31,;3.33,-1.54,;4.67,-2.31,;2,-3.85,;.66,-4.62,;-.67,-3.85,;-.67,-2.31,;-2,-1.54,;-3.34,-2.3,;.66,-6.16,;.66,-7.7,)| Show InChI InChI=1S/C24H27N3O3/c1-7-27(8-2)18-9-10-19(28-4)24-17(18)11-15(3)23(26-24)22-20(29-5)12-16(14-25)13-21(22)30-6/h9-13H,7-8H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394517
(CHEMBL2160173)Show SMILES COCCN(CC(C)C)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(1.41,9.22,;.07,8.47,;.05,6.93,;1.37,6.14,;1.35,4.6,;2.68,3.82,;4.02,4.57,;5.34,3.78,;4.04,6.11,;.01,3.85,;-1.31,4.64,;-2.66,3.88,;-2.68,2.34,;-4.02,1.59,;-5.34,2.38,;-1.35,1.56,;-1.37,.02,;-.05,-.77,;1.29,-.02,;2.62,-.8,;1.31,1.52,;-.01,2.31,;-.07,-2.31,;-1.41,-3.06,;-2.74,-2.28,;-4.08,-3.03,;-1.43,-4.6,;-.11,-5.39,;-.13,-6.93,;-1.47,-7.68,;-1.49,-9.22,;1.24,-4.64,;1.25,-3.1,;2.6,-2.34,;3.92,-3.13,)| Show InChI InChI=1S/C28H38N2O5/c1-18(2)16-30(11-12-31-4)22-9-10-23(33-6)28-21(22)13-19(3)27(29-28)26-24(34-7)14-20(17-32-5)15-25(26)35-8/h9-10,13-15,18H,11-12,16-17H2,1-8H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 65 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394516
(CHEMBL2160157)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(Cl)cc(COC)cc1OC |(3.38,8.07,;2.04,7.32,;2.01,5.78,;3.33,4.99,;4.69,5.72,;.67,5.04,;-.65,5.83,;-2,5.08,;-2.02,3.54,;-3.37,2.79,;-4.69,3.58,;-.7,2.75,;-.73,1.21,;.6,.42,;1.94,1.17,;3.26,.37,;1.96,2.7,;.64,3.5,;.57,-1.12,;1.89,-1.91,;3.24,-1.17,;1.87,-3.45,;.52,-4.2,;.5,-5.74,;1.82,-6.53,;1.8,-8.07,;-.8,-3.41,;-.77,-1.87,;-2.1,-1.08,;-3.44,-1.83,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-9-10-20(29-5)24-17(19)11-15(3)23(26-24)22-18(25)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394528
(CHEMBL2160160)Show SMILES CCN(CC)c1ccc(F)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(2.67,8.08,;1.34,7.31,;1.34,5.77,;2.67,5,;4,5.77,;0,5.01,;-1.33,5.78,;-2.67,5.01,;-2.67,3.47,;-4,2.7,;-1.33,2.7,;-1.33,1.16,;-0,.39,;1.33,1.15,;2.67,.38,;1.33,2.69,;0,3.47,;-0,-1.15,;-1.34,-1.92,;-2.67,-1.15,;-4,-1.92,;-1.34,-3.46,;-0,-4.23,;-0,-5.77,;-1.34,-6.54,;-1.34,-8.08,;1.33,-3.47,;1.33,-1.93,;2.67,-1.16,;4,-1.93,)| Show InChI InChI=1S/C24H29FN2O3/c1-7-27(8-2)19-10-9-18(25)24-17(19)11-15(3)23(26-24)22-20(29-5)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389527
(CHEMBL2063369)Show SMILES CCCN(CCC)c1ccc(C)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(41.21,8.74,;41.21,7.19,;39.88,6.41,;39.89,4.87,;41.22,4.11,;42.55,4.88,;43.89,4.12,;38.56,4.1,;37.22,4.86,;35.89,4.09,;35.89,2.55,;34.56,1.78,;37.22,1.78,;37.22,.24,;38.55,-.53,;39.89,.24,;41.23,-.52,;39.89,1.78,;38.56,2.55,;38.56,-2.07,;37.22,-2.84,;35.89,-2.07,;34.55,-2.84,;37.22,-4.38,;38.55,-5.15,;38.56,-6.69,;37.22,-7.46,;35.89,-6.69,;39.89,-4.37,;39.89,-2.83,;41.22,-2.06,;42.55,-2.83,)| Show InChI InChI=1S/C27H36N2O3/c1-8-12-29(13-9-2)22-11-10-18(3)26-21(22)14-19(4)27(28-26)25-23(31-6)15-20(17-30-5)16-24(25)32-7/h10-11,14-16H,8-9,12-13,17H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394522
(CHEMBL2160168)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(F)cc12)-c1c(OC)cc(COC)cc1OC |(3.29,8.1,;1.96,7.32,;1.97,5.78,;3.31,5.02,;4.64,5.79,;.64,5,;-.7,5.76,;-2.03,4.98,;-2.02,3.44,;-3.35,2.67,;-4.69,3.43,;-.68,2.68,;-.67,1.14,;.67,.38,;2,1.16,;3.34,.4,;1.99,2.7,;.65,3.46,;.68,-1.16,;-.65,-1.94,;-1.99,-1.18,;-3.32,-1.95,;-.64,-3.48,;.7,-4.24,;.71,-5.78,;-.62,-6.56,;-.61,-8.1,;2.03,-3.46,;2.02,-1.92,;3.35,-1.14,;4.69,-1.9,)| Show InChI InChI=1S/C24H29FN2O4/c1-7-27(8-2)18-9-10-19(29-4)23-16(18)13-17(25)24(26-23)22-20(30-5)11-15(14-28-3)12-21(22)31-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389539
(CHEMBL2063382)Show SMILES CCN(CC)c1ccc(C)c2nc(c(Cl)cc12)-c1c(OC)cc(COC)cc1OC |(62.06,-27.68,;63.4,-28.45,;63.41,-29.99,;64.74,-30.75,;64.75,-32.29,;62.08,-30.76,;60.74,-30,;59.41,-30.77,;59.41,-32.31,;58.08,-33.08,;60.74,-33.08,;60.74,-34.62,;62.07,-35.39,;63.41,-34.62,;64.75,-35.38,;63.41,-33.08,;62.08,-32.31,;62.08,-36.93,;60.74,-37.7,;59.41,-36.93,;58.07,-37.7,;60.74,-39.24,;62.07,-40.01,;62.08,-41.55,;60.74,-42.32,;59.41,-41.55,;63.41,-39.23,;63.41,-37.69,;64.74,-36.92,;66.07,-37.69,)| Show InChI InChI=1S/C24H29ClN2O3/c1-7-27(8-2)19-10-9-15(3)23-17(19)13-18(25)24(26-23)22-20(29-5)11-16(14-28-4)12-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 81 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389527
(CHEMBL2063369)Show SMILES CCCN(CCC)c1ccc(C)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(41.21,8.74,;41.21,7.19,;39.88,6.41,;39.89,4.87,;41.22,4.11,;42.55,4.88,;43.89,4.12,;38.56,4.1,;37.22,4.86,;35.89,4.09,;35.89,2.55,;34.56,1.78,;37.22,1.78,;37.22,.24,;38.55,-.53,;39.89,.24,;41.23,-.52,;39.89,1.78,;38.56,2.55,;38.56,-2.07,;37.22,-2.84,;35.89,-2.07,;34.55,-2.84,;37.22,-4.38,;38.55,-5.15,;38.56,-6.69,;37.22,-7.46,;35.89,-6.69,;39.89,-4.37,;39.89,-2.83,;41.22,-2.06,;42.55,-2.83,)| Show InChI InChI=1S/C27H36N2O3/c1-8-12-29(13-9-2)22-11-10-18(3)26-21(22)14-19(4)27(28-26)25-23(31-6)15-20(17-30-5)16-24(25)32-7/h10-11,14-16H,8-9,12-13,17H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 88 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394524
(CHEMBL2160166)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(3.37,8.06,;2.03,7.31,;2.01,5.77,;3.33,4.98,;4.69,5.72,;.67,5.01,;-.66,5.8,;-2,5.04,;-2.02,3.5,;-3.36,2.75,;-4.69,3.54,;-.69,2.72,;-.71,1.18,;.61,.39,;1.95,1.15,;3.28,.36,;1.97,2.69,;.65,3.47,;.59,-1.15,;-.75,-1.9,;-2.07,-1.11,;-3.42,-1.87,;-.77,-3.44,;.56,-4.23,;.54,-5.77,;-.8,-6.52,;-.82,-8.06,;1.9,-3.47,;1.92,-1.93,;3.26,-1.18,;4.58,-1.96,)| Show InChI InChI=1S/C25H32N2O4/c1-8-27(9-2)19-10-11-20(29-5)25-18(19)12-16(3)24(26-25)23-21(30-6)13-17(15-28-4)14-22(23)31-7/h10-14H,8-9,15H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 91 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394514
(CHEMBL2160159)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(C)cc1OC |(3.3,6.94,;1.97,6.16,;1.98,4.62,;3.32,3.86,;4.55,4.53,;.65,3.84,;-.69,4.61,;-2.02,3.83,;-2.01,2.29,;-3.34,1.52,;-4.68,2.28,;-.67,1.53,;-.67,-.01,;.67,-.78,;2,,;3.34,-.76,;1.99,1.54,;.66,2.3,;.67,-2.32,;-.66,-3.09,;-1.99,-2.33,;-3.32,-3.1,;-.65,-4.63,;.69,-5.4,;.69,-6.94,;2.02,-4.62,;2.01,-3.08,;3.34,-2.3,;4.68,-3.07,)| Show InChI InChI=1S/C24H30N2O3/c1-8-26(9-2)18-10-11-19(27-5)24-17(18)14-16(4)23(25-24)22-20(28-6)12-15(3)13-21(22)29-7/h10-14H,8-9H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394518
(CHEMBL2160171)Show SMILES CCCN(CCC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.01,7.31,;2.67,8.08,;1.34,7.31,;1.34,5.77,;2.67,5,;4,5.77,;5.34,5,;0,5.01,;-1.33,5.78,;-2.67,5.01,;-2.67,3.47,;-4,2.7,;-5.34,3.47,;-1.34,2.7,;-1.34,1.16,;-.01,.39,;1.33,1.15,;2.66,.38,;1.33,2.69,;-0,3.47,;-.01,-1.15,;-1.34,-1.92,;-2.68,-1.15,;-4.01,-1.92,;-1.35,-3.46,;-.01,-4.23,;-.01,-5.77,;-1.35,-6.54,;-1.35,-8.08,;1.32,-3.47,;1.32,-1.93,;2.66,-1.16,;3.99,-1.93,)| Show InChI InChI=1S/C27H36N2O4/c1-8-12-29(13-9-2)21-10-11-22(31-5)27-20(21)14-18(3)26(28-27)25-23(32-6)15-19(17-30-4)16-24(25)33-7/h10-11,14-16H,8-9,12-13,17H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394525
(CHEMBL2160164)Show SMILES CCN(CC)c1ccc(C#N)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.59,5.83,;3.28,5.03,;1.94,5.78,;1.92,7.32,;3.25,8.11,;.61,5,;-.73,5.75,;-2.05,4.97,;-2.04,3.43,;-3.36,2.65,;-4.69,1.86,;-.7,2.67,;-.68,1.13,;.66,.38,;1.99,1.16,;3.33,.41,;1.97,2.7,;.63,3.46,;.68,-1.16,;-.65,-1.95,;-1.99,-1.19,;-3.31,-1.97,;-.63,-3.49,;.71,-4.24,;.73,-5.78,;-.6,-6.57,;-.58,-8.11,;2.04,-3.46,;2.02,-1.92,;3.35,-1.13,;4.69,-1.89,)| Show InChI InChI=1S/C25H29N3O3/c1-7-28(8-2)20-10-9-18(14-26)25-19(20)11-16(3)24(27-25)23-21(30-5)12-17(15-29-4)13-22(23)31-6/h9-13H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 102 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394518
(CHEMBL2160171)Show SMILES CCCN(CCC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.01,7.31,;2.67,8.08,;1.34,7.31,;1.34,5.77,;2.67,5,;4,5.77,;5.34,5,;0,5.01,;-1.33,5.78,;-2.67,5.01,;-2.67,3.47,;-4,2.7,;-5.34,3.47,;-1.34,2.7,;-1.34,1.16,;-.01,.39,;1.33,1.15,;2.66,.38,;1.33,2.69,;-0,3.47,;-.01,-1.15,;-1.34,-1.92,;-2.68,-1.15,;-4.01,-1.92,;-1.35,-3.46,;-.01,-4.23,;-.01,-5.77,;-1.35,-6.54,;-1.35,-8.08,;1.32,-3.47,;1.32,-1.93,;2.66,-1.16,;3.99,-1.93,)| Show InChI InChI=1S/C27H36N2O4/c1-8-12-29(13-9-2)21-10-11-22(31-5)27-20(21)14-18(3)26(28-27)25-23(32-6)15-19(17-30-4)16-24(25)33-7/h10-11,14-16H,8-9,12-13,17H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 105 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394520
(CHEMBL2160170)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(CC)cc12)-c1c(OC)cc(COC)cc1OC |(4.67,5.76,;3.33,5,;2,5.77,;2.01,7.31,;3.35,8.08,;.67,5.01,;-.66,5.78,;-2,5.02,;-2.01,3.48,;-3.34,2.71,;-4.67,3.49,;-.68,2.7,;-.68,1.16,;.65,.39,;1.98,1.15,;3.32,.38,;4.65,1.15,;1.99,2.69,;.66,3.47,;.64,-1.15,;-.69,-1.92,;-2.03,-1.14,;-3.36,-1.91,;-.7,-3.46,;.63,-4.23,;.62,-5.77,;-.71,-6.54,;-.72,-8.08,;1.97,-3.47,;1.97,-1.93,;3.31,-1.16,;4.64,-1.94,)| Show InChI InChI=1S/C26H34N2O4/c1-8-18-15-19-20(28(9-2)10-3)11-12-21(30-5)26(19)27-25(18)24-22(31-6)13-17(16-29-4)14-23(24)32-7/h11-15H,8-10,16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 108 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389532
(CHEMBL2063375)Show SMILES CCN(CCOC)c1ccc(C)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(47.84,-10.28,;49.18,-11.04,;49.18,-12.58,;50.52,-13.35,;50.52,-14.89,;51.86,-15.65,;51.87,-17.19,;47.85,-13.36,;46.52,-12.59,;45.19,-13.36,;45.18,-14.91,;43.85,-15.68,;46.52,-15.67,;46.51,-17.21,;47.85,-17.99,;49.19,-17.21,;50.52,-17.98,;49.19,-15.67,;47.86,-14.91,;47.85,-19.52,;46.51,-20.29,;45.18,-19.52,;43.85,-20.29,;46.51,-21.83,;47.85,-22.6,;47.85,-24.14,;46.52,-24.91,;45.18,-24.14,;49.19,-21.82,;49.18,-20.29,;50.51,-19.51,;51.85,-20.28,)| Show InChI InChI=1S/C26H34N2O4/c1-8-28(11-12-29-4)21-10-9-17(2)25-20(21)13-18(3)26(27-25)24-22(31-6)14-19(16-30-5)15-23(24)32-7/h9-10,13-15H,8,11-12,16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 109 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394524
(CHEMBL2160166)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(3.37,8.06,;2.03,7.31,;2.01,5.77,;3.33,4.98,;4.69,5.72,;.67,5.01,;-.66,5.8,;-2,5.04,;-2.02,3.5,;-3.36,2.75,;-4.69,3.54,;-.69,2.72,;-.71,1.18,;.61,.39,;1.95,1.15,;3.28,.36,;1.97,2.69,;.65,3.47,;.59,-1.15,;-.75,-1.9,;-2.07,-1.11,;-3.42,-1.87,;-.77,-3.44,;.56,-4.23,;.54,-5.77,;-.8,-6.52,;-.82,-8.06,;1.9,-3.47,;1.92,-1.93,;3.26,-1.18,;4.58,-1.96,)| Show InChI InChI=1S/C25H32N2O4/c1-8-27(9-2)19-10-11-20(29-5)25-18(19)12-16(3)24(26-25)23-21(30-6)13-17(15-28-4)14-22(23)31-7/h10-14H,8-9,15H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394522
(CHEMBL2160168)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(F)cc12)-c1c(OC)cc(COC)cc1OC |(3.29,8.1,;1.96,7.32,;1.97,5.78,;3.31,5.02,;4.64,5.79,;.64,5,;-.7,5.76,;-2.03,4.98,;-2.02,3.44,;-3.35,2.67,;-4.69,3.43,;-.68,2.68,;-.67,1.14,;.67,.38,;2,1.16,;3.34,.4,;1.99,2.7,;.65,3.46,;.68,-1.16,;-.65,-1.94,;-1.99,-1.18,;-3.32,-1.95,;-.64,-3.48,;.7,-4.24,;.71,-5.78,;-.62,-6.56,;-.61,-8.1,;2.03,-3.46,;2.02,-1.92,;3.35,-1.14,;4.69,-1.9,)| Show InChI InChI=1S/C24H29FN2O4/c1-7-27(8-2)18-9-10-19(29-4)23-16(18)13-17(25)24(26-23)22-20(30-5)11-15(14-28-3)12-21(22)31-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 118 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389538
(CHEMBL2063381)Show SMILES CCN(CC)c1ccc(C)c2nc(c(F)cc12)-c1c(OC)cc(COC)cc1OC |(48.85,-28.49,;50.19,-29.26,;50.19,-30.8,;51.53,-31.56,;51.53,-33.1,;48.86,-31.57,;47.53,-30.81,;46.2,-31.58,;46.2,-33.12,;44.86,-33.89,;47.53,-33.89,;47.52,-35.43,;48.86,-36.2,;50.2,-35.43,;51.54,-36.19,;50.2,-33.89,;48.87,-33.12,;48.86,-37.74,;47.53,-38.51,;46.19,-37.74,;44.86,-38.5,;47.52,-40.05,;48.86,-40.82,;48.86,-42.36,;47.53,-43.13,;46.19,-42.36,;50.2,-40.04,;50.19,-38.5,;51.52,-37.73,;52.86,-38.5,)| Show InChI InChI=1S/C24H29FN2O3/c1-7-27(8-2)19-10-9-15(3)23-17(19)13-18(25)24(26-23)22-20(29-5)11-16(14-28-4)12-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 131 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394515
(CHEMBL2160158)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(cc1OC)C#N |(3.34,3.08,;3.34,4.62,;2.01,5.39,;2.01,6.93,;3.34,7.7,;.67,4.62,;-.66,5.39,;-2,4.62,;-2,3.08,;-3.33,2.32,;-4.67,3.09,;-.67,2.31,;-.67,.77,;.67,0,;2,.77,;3.33,-0,;2,2.31,;.67,3.08,;.67,-1.54,;2,-2.31,;3.33,-1.54,;4.67,-2.31,;2,-3.85,;.66,-4.62,;-.67,-3.85,;-.67,-2.31,;-2,-1.54,;-3.34,-2.3,;.66,-6.16,;.66,-7.7,)| Show InChI InChI=1S/C24H27N3O3/c1-7-27(8-2)18-9-10-19(28-4)24-17(18)11-15(3)23(26-24)22-20(29-5)12-16(14-25)13-21(22)30-6/h9-13H,7-8H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 132 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389538
(CHEMBL2063381)Show SMILES CCN(CC)c1ccc(C)c2nc(c(F)cc12)-c1c(OC)cc(COC)cc1OC |(48.85,-28.49,;50.19,-29.26,;50.19,-30.8,;51.53,-31.56,;51.53,-33.1,;48.86,-31.57,;47.53,-30.81,;46.2,-31.58,;46.2,-33.12,;44.86,-33.89,;47.53,-33.89,;47.52,-35.43,;48.86,-36.2,;50.2,-35.43,;51.54,-36.19,;50.2,-33.89,;48.87,-33.12,;48.86,-37.74,;47.53,-38.51,;46.19,-37.74,;44.86,-38.5,;47.52,-40.05,;48.86,-40.82,;48.86,-42.36,;47.53,-43.13,;46.19,-42.36,;50.2,-40.04,;50.19,-38.5,;51.52,-37.73,;52.86,-38.5,)| Show InChI InChI=1S/C24H29FN2O3/c1-7-27(8-2)19-10-9-15(3)23-17(19)13-18(25)24(26-23)22-20(29-5)11-16(14-28-4)12-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 144 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394521
(CHEMBL2160169)Show SMILES CCN(CC)c1ccc(OC)c2nc(c(Cl)cc12)-c1c(OC)cc(COC)cc1OC |(4.67,5.76,;3.33,5,;2,5.77,;2.01,7.31,;3.35,8.08,;.67,5.01,;-.66,5.78,;-2,5.02,;-2.01,3.48,;-3.34,2.71,;-4.67,3.49,;-.68,2.7,;-.68,1.16,;.65,.39,;1.98,1.15,;3.32,.38,;1.99,2.69,;.66,3.47,;.64,-1.15,;-.69,-1.92,;-2.03,-1.14,;-3.36,-1.91,;-.7,-3.46,;.63,-4.23,;.62,-5.77,;-.71,-6.54,;-.72,-8.08,;1.97,-3.47,;1.97,-1.93,;3.31,-1.16,;4.64,-1.94,)| Show InChI InChI=1S/C24H29ClN2O4/c1-7-27(8-2)18-9-10-19(29-4)23-16(18)13-17(25)24(26-23)22-20(30-5)11-15(14-28-3)12-21(22)31-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 144 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394517
(CHEMBL2160173)Show SMILES COCCN(CC(C)C)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(1.41,9.22,;.07,8.47,;.05,6.93,;1.37,6.14,;1.35,4.6,;2.68,3.82,;4.02,4.57,;5.34,3.78,;4.04,6.11,;.01,3.85,;-1.31,4.64,;-2.66,3.88,;-2.68,2.34,;-4.02,1.59,;-5.34,2.38,;-1.35,1.56,;-1.37,.02,;-.05,-.77,;1.29,-.02,;2.62,-.8,;1.31,1.52,;-.01,2.31,;-.07,-2.31,;-1.41,-3.06,;-2.74,-2.28,;-4.08,-3.03,;-1.43,-4.6,;-.11,-5.39,;-.13,-6.93,;-1.47,-7.68,;-1.49,-9.22,;1.24,-4.64,;1.25,-3.1,;2.6,-2.34,;3.92,-3.13,)| Show InChI InChI=1S/C28H38N2O5/c1-18(2)16-30(11-12-31-4)22-9-10-23(33-6)28-21(22)13-19(3)27(29-28)26-24(34-7)14-20(17-32-5)15-25(26)35-8/h9-10,13-15,18H,11-12,16-17H2,1-8H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389537
(CHEMBL2063380)Show SMILES CCN(CC)c1ccc(C)c2nc(ccc12)-c1c(OC)cc(COC)cc1OC Show InChI InChI=1S/C24H30N2O3/c1-7-26(8-2)20-12-9-16(3)24-18(20)10-11-19(25-24)23-21(28-5)13-17(15-27-4)14-22(23)29-6/h9-14H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 184 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394523
(CHEMBL2160167)Show SMILES CCN(CC)c1ccc(OC)c2nc(ccc12)-c1c(OC)cc(COC)cc1OC Show InChI InChI=1S/C24H30N2O4/c1-7-26(8-2)19-11-12-20(28-4)24-17(19)9-10-18(25-24)23-21(29-5)13-16(15-27-3)14-22(23)30-6/h9-14H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 202 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394528
(CHEMBL2160160)Show SMILES CCN(CC)c1ccc(F)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(2.67,8.08,;1.34,7.31,;1.34,5.77,;2.67,5,;4,5.77,;0,5.01,;-1.33,5.78,;-2.67,5.01,;-2.67,3.47,;-4,2.7,;-1.33,2.7,;-1.33,1.16,;-0,.39,;1.33,1.15,;2.67,.38,;1.33,2.69,;0,3.47,;-0,-1.15,;-1.34,-1.92,;-2.67,-1.15,;-4,-1.92,;-1.34,-3.46,;-0,-4.23,;-0,-5.77,;-1.34,-6.54,;-1.34,-8.08,;1.33,-3.47,;1.33,-1.93,;2.67,-1.16,;4,-1.93,)| Show InChI InChI=1S/C24H29FN2O3/c1-7-27(8-2)19-10-9-18(25)24-17(19)11-15(3)23(26-24)22-20(29-5)12-16(14-28-4)13-21(22)30-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 226 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394526
(CHEMBL2160163)Show SMILES CCN(CC)c1ccc(c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC)C(F)(F)F |(3.33,8.09,;2,7.32,;2,5.78,;3.33,5.01,;4.67,5.78,;.67,5,;-.67,5.77,;-2,5,;-2,3.46,;-.67,2.69,;-.67,1.15,;.67,.38,;2,1.16,;3.33,.39,;2,2.7,;.67,3.46,;.67,-1.16,;-.67,-1.93,;-2,-1.16,;-3.33,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.78,;-.67,-6.55,;-.67,-8.09,;2,-3.46,;2,-1.92,;3.33,-1.15,;4.67,-1.92,;-3.33,2.69,;-4.42,3.78,;-4.67,1.92,;-3.33,1.15,)| Show InChI InChI=1S/C25H29F3N2O3/c1-7-30(8-2)19-10-9-18(25(26,27)28)24-17(19)11-15(3)23(29-24)22-20(32-5)12-16(14-31-4)13-21(22)33-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 259 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394526
(CHEMBL2160163)Show SMILES CCN(CC)c1ccc(c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC)C(F)(F)F |(3.33,8.09,;2,7.32,;2,5.78,;3.33,5.01,;4.67,5.78,;.67,5,;-.67,5.77,;-2,5,;-2,3.46,;-.67,2.69,;-.67,1.15,;.67,.38,;2,1.16,;3.33,.39,;2,2.7,;.67,3.46,;.67,-1.16,;-.67,-1.93,;-2,-1.16,;-3.33,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.78,;-.67,-6.55,;-.67,-8.09,;2,-3.46,;2,-1.92,;3.33,-1.15,;4.67,-1.92,;-3.33,2.69,;-4.42,3.78,;-4.67,1.92,;-3.33,1.15,)| Show InChI InChI=1S/C25H29F3N2O3/c1-7-30(8-2)19-10-9-18(25(26,27)28)24-17(19)11-15(3)23(29-24)22-20(32-5)12-16(14-31-4)13-21(22)33-6/h9-13H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 288 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394523
(CHEMBL2160167)Show SMILES CCN(CC)c1ccc(OC)c2nc(ccc12)-c1c(OC)cc(COC)cc1OC Show InChI InChI=1S/C24H30N2O4/c1-7-26(8-2)19-11-12-20(28-4)24-17(19)9-10-18(25-24)23-21(29-5)13-16(15-27-3)14-22(23)30-6/h9-14H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 332 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50389537
(CHEMBL2063380)Show SMILES CCN(CC)c1ccc(C)c2nc(ccc12)-c1c(OC)cc(COC)cc1OC Show InChI InChI=1S/C24H30N2O3/c1-7-26(8-2)20-12-9-16(3)24-18(20)10-11-19(25-24)23-21(28-5)13-17(15-27-4)14-22(23)29-6/h9-14H,7-8,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 381 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-induced intracellular cAMP production preincubated... |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394519
(CHEMBL2160172)Show SMILES CCN(CCOC)c1ccc(OC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(1.98,8.1,;.65,7.32,;.66,5.78,;2,5.02,;3.33,5.8,;4.67,5.03,;5.99,5.81,;-.67,5,;-2.01,5.76,;-3.34,4.98,;-3.33,3.44,;-4.66,2.67,;-5.99,3.43,;-1.99,2.68,;-1.98,1.14,;-.64,.38,;.69,1.16,;2.03,.4,;.68,2.7,;-.66,3.46,;-.63,-1.16,;-1.96,-1.94,;-3.3,-1.18,;-4.63,-1.95,;-1.95,-3.48,;-.61,-4.24,;-.6,-5.78,;-1.93,-6.56,;-1.92,-8.1,;.72,-3.46,;.71,-1.92,;2.04,-1.14,;3.37,-1.9,)| Show InChI InChI=1S/C26H34N2O5/c1-8-28(11-12-29-3)20-9-10-21(31-5)26-19(20)13-17(2)25(27-26)24-22(32-6)14-18(16-30-4)15-23(24)33-7/h9-10,13-15H,8,11-12,16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 392 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394530
(CHEMBL2160162)Show SMILES CCN(CC)c1ccc(C(F)F)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.63,5.81,;3.3,5.02,;1.97,5.78,;1.95,7.32,;3.28,8.1,;.64,5,;-.7,5.76,;-2.03,4.98,;-2.02,3.44,;-3.35,2.66,;-4.69,3.42,;-3.34,1.12,;-.68,2.68,;-.67,1.14,;.67,.38,;2,1.16,;3.34,.4,;1.99,2.7,;.65,3.46,;.68,-1.16,;-.65,-1.94,;-1.99,-1.18,;-3.32,-1.96,;-.64,-3.48,;.7,-4.24,;.71,-5.78,;-.61,-6.56,;-.6,-8.1,;2.03,-3.46,;2.02,-1.92,;3.35,-1.14,;4.69,-1.9,)| Show InChI InChI=1S/C25H30F2N2O3/c1-7-29(8-2)19-10-9-17(25(26)27)24-18(19)11-15(3)23(28-24)22-20(31-5)12-16(14-30-4)13-21(22)32-6/h9-13,25H,7-8,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 414 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50394529
(CHEMBL2160165)Show SMILES CCN(CC)c1ccc(COC)c2nc(c(C)cc12)-c1c(OC)cc(COC)cc1OC |(4.02,8.08,;2.68,7.31,;2.68,5.77,;4.01,5,;5.34,5.77,;1.34,5.01,;.01,5.78,;-1.33,5.02,;-1.34,3.48,;-2.67,2.71,;-4,3.49,;-5.34,2.72,;-0,2.7,;-.01,1.16,;1.32,.39,;2.66,1.15,;3.99,.38,;2.66,2.69,;1.33,3.47,;1.31,-1.15,;-.02,-1.92,;-1.35,-1.14,;-2.69,-1.91,;-.03,-3.46,;1.3,-4.23,;1.29,-5.77,;-.04,-6.54,;-.05,-8.08,;2.64,-3.47,;2.64,-1.93,;3.98,-1.16,;5.31,-1.94,)| Show InChI InChI=1S/C26H34N2O4/c1-8-28(9-2)21-11-10-19(16-30-5)26-20(21)12-17(3)25(27-26)24-22(31-6)13-18(15-29-4)14-23(24)32-7/h10-14H,8-9,15-16H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs by scintillation counting |
Bioorg Med Chem 20: 6559-78 (2012)
Article DOI: 10.1016/j.bmc.2012.09.028
BindingDB Entry DOI: 10.7270/Q2B56KVZ |
More data for this
Ligand-Target Pair | |
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