Found 83 hits Enz. Inhib. hit(s) with all data for entry = 5939 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)) | BDBM101691
(US8530504, 53)Show SMILES COCCN(C1CCCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-6.47,3.14,;-5.38,4.23,;-3.9,3.83,;-2.81,4.92,;-1.32,4.52,;-.23,5.61,;1.31,5.61,;1.79,7.08,;.54,7.98,;-.71,7.08,;-.92,3.04,;-1.83,1.79,;-3.37,1.79,;-4.14,.46,;-.92,.54,;.54,1.02,;2.01,.54,;2.91,1.79,;2.01,3.04,;.54,2.56,;2.41,-.94,;3.9,-1.34,;4.98,-.25,;6.47,-.65,;4.29,-2.83,;3.2,-3.92,;3.6,-5.41,;2.51,-6.49,;2.91,-7.98,;1.72,-3.52,;1.32,-2.03,;-.17,-1.63,;-1.26,-2.72,)| Show InChI InChI=1S/C24H33N3O5S/c1-28-11-10-26(17-8-6-7-9-17)22-23(32-5)25-27-18(15-33-24(22)27)21-19(30-3)12-16(14-29-2)13-20(21)31-4/h12-13,15,17H,6-11,14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101693
(US8530504, 55)Show SMILES COCCN(CC(C)C)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.78,7.05,;-5.38,5.56,;-3.9,5.16,;-3.5,3.68,;-2.01,3.28,;-.92,4.37,;.57,3.97,;1.66,5.06,;1.66,2.88,;-1.61,1.79,;-2.52,.54,;-4.06,.54,;-4.83,-.79,;-1.61,-.7,;-.15,-.23,;1.32,-.7,;2.22,.54,;1.32,1.79,;-.15,1.31,;1.72,-2.19,;3.2,-2.59,;4.29,-1.5,;5.78,-1.9,;3.6,-4.08,;2.51,-5.16,;2.91,-6.65,;4.4,-7.05,;5.49,-5.96,;1.03,-4.77,;.63,-3.28,;-.86,-2.88,;-1.95,-3.97,)| Show InChI InChI=1S/C23H33N3O5S/c1-15(2)12-25(8-9-27-3)21-22(31-7)24-26-17(14-32-23(21)26)20-18(29-5)10-16(13-28-4)11-19(20)30-6/h10-11,14-15H,8-9,12-13H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101692
(US8530504, 54)Show SMILES COCCN(C1CCCCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-6.47,3.04,;-5.38,4.13,;-3.9,3.73,;-2.81,4.82,;-1.32,4.42,;-.23,5.51,;1.26,5.11,;2.35,6.2,;1.95,7.69,;.46,8.09,;-.63,7,;-.92,2.93,;-1.83,1.69,;-3.37,1.69,;-4.14,.35,;-.92,.44,;.54,.92,;2.01,.44,;2.91,1.69,;2.01,2.93,;.54,2.46,;2.41,-1.05,;3.9,-1.45,;4.98,-.36,;6.47,-.75,;4.29,-2.93,;3.2,-4.02,;3.6,-5.51,;2.51,-6.6,;2.91,-8.09,;1.72,-3.62,;1.32,-2.14,;-.17,-1.74,;-1.26,-2.83,)| Show InChI InChI=1S/C25H35N3O5S/c1-29-12-11-27(18-9-7-6-8-10-18)23-24(33-5)26-28-19(16-34-25(23)28)22-20(31-3)13-17(15-30-2)14-21(22)32-4/h13-14,16,18H,6-12,15H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101697
(US8530504, 59)Show SMILES CCN(C1CCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(.53,5.73,;-1.01,5.73,;-2.1,4.64,;-3.59,5.04,;-4.36,6.38,;-5.69,5.61,;-4.92,4.27,;-1.7,3.16,;-2.61,1.91,;-4.15,1.91,;-4.92,.58,;-1.7,.66,;-.24,1.14,;1.23,.66,;2.13,1.91,;1.23,3.16,;-.24,2.68,;1.63,-.82,;3.11,-1.22,;4.2,-.13,;5.69,-.53,;3.51,-2.71,;2.42,-3.8,;2.82,-5.29,;1.73,-6.38,;.25,-5.98,;.94,-3.4,;.54,-1.91,;-.95,-1.51,;-2.04,-2.6,)| Show InChI InChI=1S/C22H29N3O4S/c1-6-24(15-8-7-9-15)20-21(29-5)23-25-16(13-30-22(20)25)19-17(27-3)10-14(12-26-2)11-18(19)28-4/h10-11,13,15H,6-9,12H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101679
(US8530504, 41)Show SMILES CCCCN(CCOC)c1c(OC)nn2c(csc12)-c1c(OC)cc(COCC)cc1OC |(3.83,7.29,;2.35,7.69,;1.26,6.6,;-.23,7,;-1.32,5.91,;-2.81,6.31,;-3.9,5.22,;-5.38,5.62,;-6.47,4.53,;-.92,4.42,;-1.83,3.17,;-3.37,3.17,;-4.14,1.84,;-.92,1.93,;.54,2.4,;2.01,1.93,;2.91,3.17,;2.01,4.42,;.54,3.94,;2.41,.44,;3.9,.04,;4.98,1.13,;6.47,.73,;4.29,-1.45,;3.2,-2.53,;3.6,-4.02,;2.51,-5.11,;2.91,-6.6,;1.82,-7.69,;1.72,-2.14,;1.32,-.65,;-.17,-.25,;-1.26,-1.34,)| Show InChI InChI=1S/C24H35N3O5S/c1-7-9-10-26(11-12-28-3)22-23(31-6)25-27-18(16-33-24(22)27)21-19(29-4)13-17(15-32-8-2)14-20(21)30-5/h13-14,16H,7-12,15H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101686
(US8530504, 48)Show SMILES COCCN(CC1CCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-6.47,3.05,;-5.38,4.14,;-3.9,3.74,;-2.81,4.83,;-1.32,4.43,;-.23,5.52,;1.26,5.12,;2.03,3.79,;3.36,4.56,;2.59,5.89,;-.92,2.95,;-1.83,1.7,;-3.37,1.7,;-4.14,.37,;-.92,.45,;.54,.93,;2.01,.45,;2.91,1.7,;2.01,2.95,;.54,2.47,;2.41,-1.03,;3.9,-1.43,;4.98,-.34,;6.47,-.74,;4.29,-2.92,;3.2,-4.01,;3.6,-5.5,;5.09,-5.89,;6.18,-4.81,;1.72,-3.61,;1.32,-2.12,;-.17,-1.72,;-1.26,-2.81,)| Show InChI InChI=1S/C24H33N3O5S/c1-28-10-9-26(13-16-7-6-8-16)22-23(32-5)25-27-18(15-33-24(22)27)21-19(30-3)11-17(14-29-2)12-20(21)31-4/h11-12,15-16H,6-10,13-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101663
(US8530504, 24)Show SMILES CCCN(CCC)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(1.46,6.15,;.37,5.06,;-1.12,5.46,;-2.21,4.37,;-3.7,4.77,;-4.09,6.25,;-5.58,6.65,;-1.81,2.88,;-2.72,1.63,;-4.26,1.63,;-5.03,.3,;-1.81,.39,;-.35,.86,;1.12,.39,;2.02,1.63,;1.12,2.88,;-.35,2.4,;1.52,-1.1,;3.01,-1.5,;4.09,-.41,;5.58,-.81,;3.4,-2.99,;2.32,-4.08,;2.71,-5.56,;1.62,-6.65,;.14,-6.25,;.83,-3.68,;.43,-2.19,;-1.06,-1.79,;-2.15,-2.88,)| Show InChI InChI=1S/C22H31N3O4S/c1-7-9-24(10-8-2)20-21(29-6)23-25-16(14-30-22(20)25)19-17(27-4)11-15(13-26-3)12-18(19)28-5/h11-12,14H,7-10,13H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101704
(US8530504, 66)Show SMILES CCN(C1CCCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(.72,5.67,;-.82,5.67,;-1.91,4.58,;-3.39,4.98,;-3.87,6.44,;-5.41,6.44,;-5.88,4.98,;-4.64,4.07,;-1.51,3.09,;-2.41,1.84,;-3.95,1.84,;-4.72,.51,;-1.51,.6,;-.04,1.07,;1.42,.6,;2.33,1.84,;1.42,3.09,;-.04,2.61,;1.82,-.89,;3.31,-1.29,;4.4,-.2,;5.88,-.6,;3.71,-2.78,;2.62,-3.86,;3.02,-5.35,;1.93,-6.44,;.44,-6.04,;1.13,-3.47,;.73,-1.98,;-.76,-1.58,;-1.84,-2.67,)| Show InChI InChI=1S/C23H31N3O4S/c1-6-25(16-9-7-8-10-16)21-22(30-5)24-26-17(14-31-23(21)26)20-18(28-3)11-15(13-27-2)12-19(20)29-4/h11-12,14,16H,6-10,13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101684
(US8530504, 46)Show SMILES CCCN(C1CCOC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COCC)cc1OC |(-6.53,3.14,;-5.04,2.74,;-3.95,3.83,;-2.46,3.43,;-1.37,4.52,;-1.85,5.99,;-.6,6.89,;.64,5.99,;.17,4.52,;-2.06,1.95,;-2.97,.7,;-4.51,.7,;-5.28,-.63,;-2.06,-.54,;-.6,-.07,;.87,-.54,;1.77,.7,;.87,1.95,;-.6,1.47,;1.27,-2.03,;2.75,-2.43,;3.84,-1.34,;5.33,-1.74,;3.15,-3.92,;2.06,-5.01,;2.46,-6.49,;3.95,-6.89,;5.04,-5.8,;6.53,-6.2,;.57,-4.61,;.18,-3.12,;-1.31,-2.72,;-2.4,-3.81,)| Show InChI InChI=1S/C24H33N3O5S/c1-6-9-26(17-8-10-32-14-17)22-23(30-5)25-27-18(15-33-24(22)27)21-19(28-3)11-16(13-31-7-2)12-20(21)29-4/h11-12,15,17H,6-10,13-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101694
(US8530504, 56)Show SMILES COCCN(C1CCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.78,7.05,;-5.38,5.56,;-3.9,5.16,;-3.5,3.68,;-2.01,3.28,;-.92,4.37,;.57,4.77,;.17,6.25,;-1.32,5.85,;-1.61,1.79,;-2.52,.54,;-4.06,.54,;-4.83,-.79,;-1.61,-.7,;-.15,-.23,;1.32,-.7,;2.22,.54,;1.32,1.79,;-.15,1.31,;1.72,-2.19,;3.2,-2.59,;4.29,-1.5,;5.78,-1.9,;3.6,-4.08,;2.51,-5.16,;2.91,-6.65,;4.4,-7.05,;5.49,-5.96,;1.03,-4.77,;.63,-3.28,;-.86,-2.88,;-1.95,-3.97,)| Show InChI InChI=1S/C23H31N3O5S/c1-27-10-9-25(16-7-6-8-16)21-22(31-5)24-26-17(14-32-23(21)26)20-18(29-3)11-15(13-28-2)12-19(20)30-4/h11-12,14,16H,6-10,13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101685
(US8530504, 47)Show SMILES CCOCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 |(6.1,-6.47,;4.62,-6.07,;3.53,-7.16,;2.04,-6.76,;1.64,-5.27,;2.73,-4.18,;2.33,-2.7,;3.42,-1.61,;4.91,-2.01,;.84,-2.3,;.44,-.81,;1.35,.44,;.44,1.68,;-1.02,1.21,;-2.48,1.68,;-2.88,3.17,;-4.37,3.57,;-4.77,5.06,;-4,6.39,;-5.33,7.16,;-6.1,5.83,;-1.79,4.26,;-2.27,5.72,;-1.02,6.63,;.22,5.72,;-.25,4.26,;-3.39,.44,;-4.93,.44,;-5.7,-.9,;-2.48,-.81,;-1.02,-.33,;-.25,-3.39,;-1.73,-2.99,;-2.82,-4.08,;.15,-4.87,)| Show InChI InChI=1S/C26H35N3O5S/c1-5-33-14-18-11-21(30-2)23(22(12-18)31-3)20-16-35-26-24(25(32-4)27-29(20)26)28(13-17-7-6-8-17)19-9-10-34-15-19/h11-12,16-17,19H,5-10,13-15H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101678
(US8530504, 40)Show SMILES CCOCc1cc(OC)c(-c2csc3c(N(CCOC)CC4CC4)c(OC)nn23)c(OC)c1 |(1.28,-7.69,;2.37,-6.6,;1.97,-5.11,;3.06,-4.02,;2.66,-2.53,;3.75,-1.45,;3.35,.04,;4.44,1.13,;5.93,.73,;1.86,.44,;1.46,1.93,;2.37,3.17,;1.46,4.42,;,3.94,;-1.46,4.42,;-1.86,5.91,;-.77,7,;.71,6.6,;1.8,7.69,;3.29,7.29,;-3.35,6.31,;-4.44,5.22,;-5.93,4.82,;-4.84,3.73,;-2.37,3.17,;-3.91,3.17,;-4.68,1.84,;-1.46,1.93,;,2.4,;.77,-.65,;-.71,-.25,;-1.8,-1.34,;1.17,-2.14,)| Show InChI InChI=1S/C24H33N3O5S/c1-6-32-14-17-11-19(29-3)21(20(12-17)30-4)18-15-33-24-22(23(31-5)25-27(18)24)26(9-10-28-2)13-16-7-8-16/h11-12,15-16H,6-10,13-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101665
(US8530504, 26)Show SMILES COc1nn2c(csc2c1N(CC1CC1)CC1CCOC1)-c1c(OC)cc(C)cc1OC |(-5.22,-.79,;-4.45,.54,;-2.91,.54,;-2.01,-.7,;-.54,-.23,;.92,-.7,;1.83,.54,;.92,1.79,;-.54,1.31,;-2.01,1.79,;-2.41,3.28,;-3.9,3.68,;-4.29,5.16,;-3.9,6.65,;-5.38,6.25,;-1.32,4.37,;.22,4.37,;1.13,3.12,;2.59,3.6,;2.59,5.14,;1.13,5.61,;1.32,-2.19,;2.81,-2.59,;3.9,-1.5,;5.38,-1.9,;3.2,-4.08,;2.12,-5.16,;2.51,-6.65,;.63,-4.77,;.23,-3.28,;-1.26,-2.88,;-2.35,-3.97,)| Show InChI InChI=1S/C24H31N3O4S/c1-15-9-19(28-2)21(20(10-15)29-3)18-14-32-24-22(23(30-4)25-27(18)24)26(11-16-5-6-16)12-17-7-8-31-13-17/h9-10,14,16-17H,5-8,11-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101698
(US8530504, 60)Show SMILES COc1nn2c(csc2c1N(CC1CC1)CC1CCOC1)-c1c(OC)cc(cc1OC)C1CC1 |(-4.68,.84,;-3.91,2.18,;-2.37,2.18,;-1.46,.93,;,1.41,;1.46,.93,;2.37,2.18,;1.46,3.42,;,2.95,;-1.46,3.42,;-1.86,4.91,;-3.35,5.31,;-4.44,4.22,;-5.93,3.82,;-4.84,2.73,;-.77,6,;.71,5.6,;1.19,4.14,;2.73,4.14,;3.21,5.6,;1.96,6.51,;1.86,-.56,;3.35,-.95,;4.44,.13,;5.93,-.26,;3.75,-2.44,;2.66,-3.53,;1.17,-3.13,;.77,-1.65,;-.71,-1.25,;-1.8,-2.34,;3.06,-5.02,;2.66,-6.51,;4.15,-6.11,)| Show InChI InChI=1S/C26H33N3O4S/c1-30-21-10-19(18-6-7-18)11-22(31-2)23(21)20-15-34-26-24(25(32-3)27-29(20)26)28(12-16-4-5-16)13-17-8-9-33-14-17/h10-11,15-18H,4-9,12-14H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101723
(US8530504, 86)Show SMILES CCCN(c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC)c1ccccn1 |(-5.58,5.96,;-4.09,5.56,;-3.7,4.08,;-2.21,3.68,;-1.81,2.19,;-2.72,.94,;-4.26,.94,;-5.03,-.39,;-1.81,-.3,;-.35,.17,;1.12,-.3,;2.02,.94,;1.12,2.19,;-.35,1.71,;1.52,-1.79,;3.01,-2.19,;4.09,-1.1,;5.58,-1.5,;3.4,-3.68,;2.32,-4.77,;2.71,-6.25,;1.62,-7.34,;.14,-6.94,;.83,-4.37,;.43,-2.88,;-1.06,-2.48,;-2.15,-3.57,;-1.12,4.77,;-1.52,6.25,;-.43,7.34,;1.06,6.94,;1.46,5.46,;.37,4.37,)| Show InChI InChI=1S/C24H28N4O4S/c1-6-11-27(20-9-7-8-10-25-20)22-23(32-5)26-28-17(15-33-24(22)28)21-18(30-3)12-16(14-29-2)13-19(21)31-4/h7-10,12-13,15H,6,11,14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101680
(US8530504, 42)Show SMILES CCOCc1cc(OC)c(-c2csc3c(N(CCCOC)CC4CC4)c(OC)nn23)c(OC)c1 |(1.28,-8.03,;2.37,-6.94,;1.97,-5.46,;3.06,-4.37,;2.66,-2.88,;3.75,-1.79,;3.35,-.3,;4.44,.79,;5.93,.39,;1.86,.1,;1.46,1.58,;2.37,2.83,;1.46,4.08,;,3.6,;-1.46,4.08,;-1.86,5.56,;-.77,6.65,;.71,6.25,;1.8,7.34,;3.29,6.94,;4.38,8.03,;-3.35,5.96,;-4.44,4.87,;-5.93,4.47,;-4.84,3.38,;-2.37,2.83,;-3.91,2.83,;-4.68,1.5,;-1.46,1.58,;,2.06,;.77,-.99,;-.71,-.59,;-1.8,-1.68,;1.17,-2.48,)| Show InChI InChI=1S/C25H35N3O5S/c1-6-33-15-18-12-20(30-3)22(21(13-18)31-4)19-16-34-25-23(24(32-5)26-28(19)25)27(10-7-11-29-2)14-17-8-9-17/h12-13,16-17H,6-11,14-15H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101689
(US8530504, 51)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC(C)OC)CC4CC4)c(OC)nn23)c(OC)c1 |(5.49,-5.96,;4.4,-7.05,;2.91,-6.65,;2.51,-5.16,;3.6,-4.08,;3.2,-2.59,;4.29,-1.5,;5.78,-1.9,;1.72,-2.19,;1.32,-.7,;2.22,.54,;1.32,1.79,;-.15,1.31,;-1.61,1.79,;-2.01,3.28,;-3.5,3.68,;-3.9,5.16,;-2.81,6.25,;-5.38,5.56,;-5.78,7.05,;-.92,4.37,;.57,3.97,;1.66,2.88,;2.05,4.37,;-2.52,.54,;-4.06,.54,;-4.83,-.79,;-1.61,-.7,;-.15,-.23,;.63,-3.28,;-.86,-2.88,;-1.95,-3.97,;1.03,-4.77,)| Show InChI InChI=1S/C24H33N3O5S/c1-15(29-3)11-26(12-16-7-8-16)22-23(32-6)25-27-18(14-33-24(22)27)21-19(30-4)9-17(13-28-2)10-20(21)31-5/h9-10,14-16H,7-8,11-13H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101724
(US8530504, 87)Show SMILES CCCN(c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC)c1cccnc1 |(-5.58,5.96,;-4.09,5.56,;-3.7,4.08,;-2.21,3.68,;-1.81,2.19,;-2.72,.94,;-4.26,.94,;-5.03,-.39,;-1.81,-.3,;-.35,.17,;1.12,-.3,;2.02,.94,;1.12,2.19,;-.35,1.71,;1.52,-1.79,;.43,-2.88,;-1.06,-2.48,;-2.15,-3.57,;.83,-4.37,;2.32,-4.77,;2.71,-6.25,;1.62,-7.34,;.14,-6.94,;3.4,-3.68,;3.01,-2.19,;4.09,-1.1,;5.58,-1.5,;-1.12,4.77,;-1.52,6.25,;-.43,7.34,;1.06,6.94,;1.46,5.46,;.37,4.37,)| Show InChI InChI=1S/C24H28N4O4S/c1-6-10-27(17-8-7-9-25-13-17)22-23(32-5)26-28-18(15-33-24(22)28)21-19(30-3)11-16(14-29-2)12-20(21)31-4/h7-9,11-13,15H,6,10,14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM5108
(US8530504, 76)Show SMILES CCc1sc2c(NC(=O)C3(O)CC3)c(OC)nn2c1-c1c(OC)cc(COC)cc1OC |(4.71,2.99,;3.94,1.65,;2.4,1.65,;1.49,2.9,;.03,2.42,;-1.44,2.9,;-1.91,4.36,;-.88,5.51,;-1.36,6.97,;.62,5.19,;.23,3.7,;1.96,5.96,;1.71,4.1,;-2.34,1.65,;-3.88,1.65,;-4.65,.32,;-1.44,.41,;.03,.88,;1.49,.41,;1.89,-1.08,;.8,-2.17,;-.69,-1.77,;-1.77,-2.86,;1.2,-3.66,;2.69,-4.05,;3.09,-5.54,;2,-6.63,;2.4,-8.12,;3.78,-2.97,;3.38,-1.48,;4.47,-.39,;5.96,-.79,)| Show InChI InChI=1S/C22H27N3O6S/c1-6-15-18(16-13(29-3)9-12(11-28-2)10-14(16)30-4)25-20(32-15)17(19(24-25)31-5)23-21(26)22(27)7-8-22/h9-10,27H,6-8,11H2,1-5H3,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101643
(US8530504, 2)Show SMILES CCCN(CCC)c1c(C)nn2c(c(SC)sc12)-c1c(OC)cc(COC)cc1OC |(2.99,6.26,;1.66,5.49,;.33,6.26,;-1.01,5.49,;-2.34,6.26,;-3.68,5.49,;-5.01,6.26,;-1.01,3.95,;-2.25,3.04,;-3.59,3.81,;-1.78,1.58,;-.24,1.58,;1.01,.67,;2.25,1.58,;3.59,.81,;4.92,1.58,;1.78,3.04,;.24,3.04,;1.01,-.87,;2.34,-1.64,;3.68,-.87,;5.01,-1.64,;2.34,-3.18,;1.01,-3.95,;1.01,-5.49,;2.34,-6.26,;3.68,-5.49,;-.33,-3.18,;-.33,-1.64,;-1.66,-.87,;-2.99,-1.64,)| Show InChI InChI=1S/C23H33N3O3S2/c1-8-10-25(11-9-2)20-15(3)24-26-21(23(30-7)31-22(20)26)19-17(28-5)12-16(14-27-4)13-18(19)29-6/h12-13H,8-11,14H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101699
(US8530504, 61)Show SMILES CCCN(C1CCOCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(cc1OC)C1CC1 |(-5.93,3.58,;-4.44,3.19,;-3.35,4.27,;-1.86,3.88,;-.77,4.96,;.71,4.57,;1.8,5.66,;1.4,7.14,;-.08,7.54,;-1.17,6.45,;-1.46,2.39,;-2.37,1.14,;-3.91,1.14,;-4.68,-.19,;-1.46,-.1,;,.37,;1.46,-.1,;2.37,1.14,;1.46,2.39,;,1.91,;1.86,-1.59,;3.35,-1.99,;4.44,-.9,;5.93,-1.3,;3.75,-3.48,;2.66,-4.57,;1.17,-4.17,;.77,-2.68,;-.71,-2.28,;-1.8,-3.37,;3.06,-6.05,;2.66,-7.54,;4.15,-7.14,)| Show InChI InChI=1S/C25H33N3O4S/c1-5-10-27(18-8-11-32-12-9-18)23-24(31-4)26-28-19(15-33-25(23)28)22-20(29-2)13-17(16-6-7-16)14-21(22)30-3/h13-16,18H,5-12H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101666
(US8530504, 28)Show SMILES CCCCN(CCOC)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(3.14,4.66,;1.66,5.06,;.57,3.97,;-.92,4.37,;-2.01,3.28,;-3.5,3.68,;-3.9,5.16,;-5.38,5.56,;-5.78,7.05,;-1.61,1.79,;-2.52,.54,;-4.06,.54,;-4.83,-.79,;-1.61,-.7,;-.15,-.23,;1.32,-.7,;2.22,.54,;1.32,1.79,;-.15,1.31,;1.72,-2.19,;3.2,-2.59,;4.29,-1.5,;5.78,-1.9,;3.6,-4.08,;2.51,-5.16,;2.91,-6.65,;4.4,-7.05,;5.49,-5.96,;1.03,-4.77,;.63,-3.28,;-.86,-2.88,;-1.95,-3.97,)| Show InChI InChI=1S/C23H33N3O5S/c1-7-8-9-25(10-11-27-2)21-22(31-6)24-26-17(15-32-23(21)26)20-18(29-4)12-16(14-28-3)13-19(20)30-5/h12-13,15H,7-11,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101664
(US8530504, 25)Show SMILES COc1nn2c(csc2c1N(CC1CC1)C1CCOCC1)-c1c(OC)cc(C)cc1OC |(-5.22,-.94,;-4.45,.4,;-2.91,.4,;-2.01,-.85,;-.54,-.37,;.92,-.85,;1.83,.4,;.92,1.64,;-.54,1.17,;-2.01,1.64,;-2.41,3.13,;-3.9,3.53,;-4.29,5.02,;-3.9,6.51,;-5.38,6.11,;-1.32,4.22,;.17,3.82,;1.26,4.91,;.86,6.4,;-.63,6.8,;-1.72,5.71,;1.32,-2.33,;.23,-3.42,;-1.26,-3.03,;-2.35,-4.11,;.63,-4.91,;2.12,-5.31,;2.51,-6.8,;3.2,-4.22,;2.81,-2.73,;3.9,-1.64,;5.38,-2.04,)| Show InChI InChI=1S/C24H31N3O4S/c1-15-11-19(28-2)21(20(12-15)29-3)18-14-32-24-22(23(30-4)25-27(18)24)26(13-16-5-6-16)17-7-9-31-10-8-17/h11-12,14,16-17H,5-10,13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101662
(US8530504, 23)Show SMILES CCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 |(1.97,-6.31,;3.06,-5.22,;2.66,-3.73,;1.17,-3.33,;.77,-1.84,;-.71,-1.45,;-1.8,-2.53,;1.86,-.76,;1.46,.73,;2.37,1.98,;1.46,3.22,;,2.75,;-1.46,3.22,;-1.86,4.71,;-3.35,5.11,;-4.44,4.02,;-5.93,3.62,;-4.84,2.53,;-.77,5.8,;.71,5.4,;1.19,3.94,;2.73,3.94,;3.21,5.4,;1.96,6.31,;-2.37,1.98,;-3.91,1.98,;-4.68,.64,;-1.46,.73,;,1.21,;3.35,-1.15,;4.44,-.07,;5.93,-.46,;3.75,-2.64,)| Show InChI InChI=1S/C25H33N3O4S/c1-5-16-10-20(29-2)22(21(11-16)30-3)19-15-33-25-23(24(31-4)26-28(19)25)27(12-17-6-7-17)13-18-8-9-32-14-18/h10-11,15,17-18H,5-9,12-14H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101681
(US8530504, 43)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC(C)C)C4CCOC4)c(OC)nn23)c(OC)c1 |(.14,-6.66,;1.62,-7.06,;2.71,-5.97,;2.32,-4.49,;3.4,-3.4,;3.01,-1.91,;4.09,-.82,;5.58,-1.22,;1.52,-1.51,;1.12,-.02,;2.02,1.22,;1.12,2.47,;-.35,1.99,;-1.81,2.47,;-2.21,3.96,;-3.7,4.36,;-4.09,5.84,;-3.01,6.93,;-5.58,6.24,;-1.12,5.05,;.35,4.57,;1.25,5.82,;.35,7.06,;-1.12,6.59,;-2.72,1.22,;-4.26,1.22,;-5.03,-.11,;-1.81,-.02,;-.35,.45,;.43,-2.6,;-1.06,-2.2,;-2.15,-3.29,;.83,-4.09,)| Show InChI InChI=1S/C24H33N3O5S/c1-15(2)11-26(17-7-8-32-13-17)22-23(31-6)25-27-18(14-33-24(22)27)21-19(29-4)9-16(12-28-3)10-20(21)30-5/h9-10,14-15,17H,7-8,11-13H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101667
(US8530504, 29)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 |(5.59,-5.01,;4.5,-6.1,;3.02,-5.7,;2.62,-4.21,;1.13,-3.81,;.73,-2.32,;-.76,-1.92,;-1.84,-3.01,;1.82,-1.23,;1.42,.25,;2.33,1.5,;1.42,2.74,;-.04,2.27,;-1.51,2.74,;-1.91,4.23,;-.82,5.32,;.67,4.92,;1.44,3.59,;2.77,4.36,;2,5.69,;-3.39,4.63,;-4.64,3.73,;-5.88,4.63,;-5.41,6.1,;-3.87,6.1,;-2.41,1.5,;-3.95,1.5,;-4.72,.17,;-1.51,.25,;-.04,.73,;3.31,-1.63,;4.4,-.54,;5.88,-.94,;3.71,-3.12,)| Show InChI InChI=1S/C25H33N3O5S/c1-29-13-17-10-20(30-2)22(21(11-17)31-3)19-15-34-25-23(24(32-4)26-28(19)25)27(12-16-6-5-7-16)18-8-9-33-14-18/h10-11,15-16,18H,5-9,12-14H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101727
(US8530504, 93)Show SMILES CCCN(CC1C2COCC12)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.78,6.11,;-4.29,5.71,;-3.9,4.22,;-2.41,3.82,;-1.32,4.91,;.22,4.91,;1.55,4.14,;3.02,3.67,;3.92,4.91,;3.02,6.16,;1.55,5.68,;-2.01,2.33,;-2.91,1.09,;-4.45,1.09,;-5.22,-.24,;-2.01,-.16,;-.54,.32,;.92,-.16,;1.83,1.09,;.92,2.33,;-.54,1.86,;1.32,-1.64,;2.81,-2.04,;3.9,-.95,;5.38,-1.35,;3.2,-3.53,;2.12,-4.62,;2.51,-6.11,;1.43,-7.2,;-.06,-6.8,;.63,-4.22,;.23,-2.73,;-1.26,-2.33,;-2.35,-3.42,)| Show InChI InChI=1S/C25H33N3O5S/c1-6-7-27(10-16-17-12-33-13-18(16)17)23-24(32-5)26-28-19(14-34-25(23)28)22-20(30-3)8-15(11-29-2)9-21(22)31-4/h8-9,14,16-18H,6-7,10-13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101729
(US8530504, 197 | US8530504, 94 | US8530504, 96)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4C5COCC45)c(OC)nn23)c(OC)c1 |(-.06,-6.8,;1.43,-7.2,;2.51,-6.11,;2.12,-4.62,;3.2,-3.53,;2.81,-2.04,;3.9,-.95,;5.38,-1.35,;1.32,-1.64,;.92,-.16,;1.83,1.09,;.92,2.33,;-.54,1.86,;-2.01,2.33,;-2.41,3.82,;-3.9,4.22,;-4.29,5.71,;-3.9,7.2,;-5.38,6.8,;-1.32,4.91,;.22,4.91,;1.55,4.14,;3.02,3.67,;3.92,4.91,;3.02,6.16,;1.55,5.68,;-2.91,1.09,;-4.45,1.09,;-5.22,-.24,;-2.01,-.16,;-.54,.32,;.23,-2.73,;-1.26,-2.33,;-2.35,-3.42,;.63,-4.22,)| Show InChI InChI=1S/C26H33N3O5S/c1-30-11-16-7-21(31-2)23(22(8-16)32-3)20-14-35-26-24(25(33-4)27-29(20)26)28(9-15-5-6-15)10-17-18-12-34-13-19(17)18/h7-8,14-15,17-19H,5-6,9-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50398587
(CHEMBL2179197 | US8530504, 4)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOCC4)c(C)nn23)c(OC)c1 |(17.24,-37.02,;16.5,-35.68,;14.96,-35.65,;14.21,-34.3,;12.67,-34.28,;11.93,-32.93,;10.39,-32.91,;9.59,-34.23,;12.71,-31.61,;11.97,-30.27,;12.84,-29.01,;11.92,-27.78,;10.46,-28.29,;8.99,-27.85,;8.44,-26.4,;6.92,-26.15,;5.95,-27.34,;4.51,-27.89,;5.71,-28.86,;9.2,-25.06,;8.41,-23.74,;9.16,-22.4,;8.37,-21.07,;6.83,-21.09,;6.08,-22.44,;6.87,-23.76,;8.11,-29.11,;6.57,-29.14,;9.04,-30.33,;10.5,-29.82,;14.25,-31.64,;15.05,-30.32,;16.58,-30.34,;15,-32.99,)| Show InChI InChI=1S/C26H35N3O4S/c1-17-25(28(13-18-5-6-18)14-19-7-9-33-10-8-19)26-29(27-17)21(16-34-26)24-22(31-3)11-20(15-30-2)12-23(24)32-4/h11-12,16,18-19H,5-10,13-15H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101719
(US8530504, 83)Show SMILES CCCCN(C1CCOCC1)c1c(OCC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(3.49,5.75,;2,6.15,;.91,5.06,;-.57,5.46,;-1.66,4.37,;-3.15,4.77,;-4.24,3.68,;-5.73,4.08,;-6.13,5.56,;-5.04,6.65,;-3.55,6.25,;-1.27,2.88,;-2.17,1.63,;-3.71,1.63,;-4.48,.3,;-6.02,.3,;-1.27,.39,;.2,.86,;1.66,.39,;2.57,1.63,;1.66,2.88,;.2,2.4,;2.06,-1.1,;.97,-2.19,;-.51,-1.79,;-1.6,-2.88,;1.37,-3.68,;2.86,-4.08,;3.26,-5.56,;2.17,-6.65,;.68,-6.25,;3.95,-2.99,;3.55,-1.5,;4.64,-.41,;6.13,-.81,)| Show InChI InChI=1S/C26H37N3O5S/c1-6-8-11-28(19-9-12-33-13-10-19)24-25(34-7-2)27-29-20(17-35-26(24)29)23-21(31-4)14-18(16-30-3)15-22(23)32-5/h14-15,17,19H,6-13,16H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM4895
(US850504, 92)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4=CCOCC4)c(OC)nn23)c(OC)c1 |t:21,(-.06,-6.8,;1.43,-7.2,;2.51,-6.11,;2.12,-4.62,;3.2,-3.53,;2.81,-2.04,;3.9,-.95,;5.38,-1.35,;1.32,-1.64,;.92,-.16,;1.83,1.09,;.92,2.33,;-.54,1.86,;-2.01,2.33,;-2.41,3.82,;-3.9,4.22,;-4.29,5.71,;-3.9,7.2,;-5.38,6.8,;-1.32,4.91,;.22,4.91,;.99,6.25,;2.53,6.25,;3.3,4.91,;2.53,3.58,;.99,3.58,;-2.91,1.09,;-4.45,1.09,;-5.22,-.24,;-2.01,-.16,;-.54,.32,;.23,-2.73,;-1.26,-2.33,;-2.35,-3.42,;.63,-4.22,)| Show InChI InChI=1S/C26H33N3O5S/c1-30-15-19-11-21(31-2)23(22(12-19)32-3)20-16-35-26-24(25(33-4)27-29(20)26)28(13-17-5-6-17)14-18-7-9-34-10-8-18/h7,11-12,16-17H,5-6,8-10,13-15H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101683
(US8530504, 45)Show SMILES CCOCCN(CC1CC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-7.22,3.64,;-5.73,3.24,;-4.64,4.33,;-3.15,3.93,;-2.06,5.02,;-.57,4.62,;.51,5.71,;2,5.31,;3.09,4.22,;3.49,5.71,;-.18,3.13,;-1.08,1.89,;-2.62,1.89,;-3.39,.55,;-.18,.64,;1.29,1.12,;2.75,.64,;3.66,1.89,;2.75,3.13,;1.29,2.66,;3.15,-.85,;4.64,-1.25,;5.73,-.16,;7.22,-.56,;5.04,-2.73,;3.95,-3.82,;4.35,-5.31,;5.83,-5.71,;6.92,-4.62,;2.46,-3.42,;2.06,-1.94,;.57,-1.54,;-.51,-2.63,)| Show InChI InChI=1S/C24H33N3O5S/c1-6-32-10-9-26(13-16-7-8-16)22-23(31-5)25-27-18(15-33-24(22)27)21-19(29-3)11-17(14-28-2)12-20(21)30-4/h11-12,15-16H,6-10,13-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50398578
(CHEMBL2179183 | US8530504, 27)Show SMILES COCCN(CC1CC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(28.52,-1.59,;26.98,-1.6,;26.23,-2.94,;24.69,-2.96,;23.93,-4.3,;22.41,-4.05,;21.44,-5.25,;19.99,-5.79,;21.19,-6.77,;24.47,-5.75,;23.59,-7.01,;22.06,-7.04,;21.32,-8.39,;24.52,-8.23,;25.98,-7.73,;27.46,-8.17,;28.33,-6.91,;27.4,-5.68,;25.95,-6.19,;28.2,-9.52,;27.42,-10.84,;25.87,-10.81,;25.08,-12.13,;28.16,-12.18,;29.7,-12.21,;30.45,-13.56,;31.99,-13.58,;32.73,-14.93,;30.49,-10.89,;29.74,-9.54,;30.53,-8.23,;32.07,-8.25,)| Show InChI InChI=1S/C23H31N3O5S/c1-27-9-8-25(12-15-6-7-15)21-22(31-5)24-26-17(14-32-23(21)26)20-18(29-3)10-16(13-28-2)11-19(20)30-4/h10-11,14-15H,6-9,12-13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101707
(US8530504, 69)Show SMILES COCCCN(C1CCCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(cc1OC)C1CC1 |(-7.22,3,;-5.73,2.6,;-4.64,3.69,;-3.15,3.29,;-2.06,4.38,;-.57,3.98,;.51,5.07,;2.05,5.07,;2.53,6.53,;1.28,7.44,;.04,6.53,;-.18,2.49,;-1.08,1.25,;-2.62,1.25,;-3.39,-.09,;-.18,-0,;1.29,.48,;2.75,-0,;3.66,1.25,;2.75,2.49,;1.29,2.02,;3.15,-1.49,;2.06,-2.58,;.57,-2.18,;-.51,-3.27,;2.46,-4.06,;3.95,-4.46,;5.04,-3.37,;4.64,-1.89,;5.73,-.8,;7.22,-1.2,;4.35,-5.95,;3.95,-7.44,;5.44,-7.04,)| Show InChI InChI=1S/C26H35N3O4S/c1-30-13-7-12-28(19-8-5-6-9-19)24-25(33-4)27-29-20(16-34-26(24)29)23-21(31-2)14-18(17-10-11-17)15-22(23)32-3/h14-17,19H,5-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101668
(US8530504, 30)Show SMILES COc1nn2c(csc2c1N(CC1CC1)CC1CCOC1)-c1c(OC)cc(Cl)cc1OC |(-4.68,.1,;-3.91,1.43,;-2.37,1.43,;-1.46,.19,;,.66,;1.46,.19,;2.37,1.43,;1.46,2.68,;,2.2,;-1.46,2.68,;-1.86,4.17,;-3.35,4.57,;-4.44,3.48,;-5.93,3.08,;-4.84,1.99,;-.77,5.26,;.71,4.86,;1.19,3.39,;2.73,3.39,;3.21,4.86,;1.96,5.76,;1.86,-1.3,;3.35,-1.7,;4.44,-.61,;5.93,-1.01,;3.75,-3.19,;2.66,-4.28,;3.06,-5.76,;1.17,-3.88,;.77,-2.39,;-.71,-1.99,;-1.8,-3.08,)| Show InChI InChI=1S/C23H28ClN3O4S/c1-28-18-8-16(24)9-19(29-2)20(18)17-13-32-23-21(22(30-3)25-27(17)23)26(10-14-4-5-14)11-15-6-7-31-12-15/h8-9,13-15H,4-7,10-12H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101647
(US8530504, 8)Show SMILES COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 |(2.37,-7.05,;1.97,-5.56,;3.06,-4.47,;2.66,-2.99,;1.17,-2.59,;.77,-1.1,;-.71,-.7,;-1.8,-1.79,;1.86,-.01,;1.46,1.48,;2.37,2.72,;3.91,2.72,;1.46,3.97,;,3.49,;-1.46,3.97,;-1.86,5.46,;-3.35,5.85,;-4.44,4.76,;-5.93,4.37,;-4.84,3.28,;-.77,6.54,;.71,6.15,;1.19,4.68,;2.73,4.68,;3.21,6.15,;1.96,7.05,;-2.37,2.72,;-3.91,2.72,;-4.68,1.39,;-1.46,1.48,;,1.95,;3.35,-.41,;4.44,.68,;5.93,.28,;3.75,-1.9,)| Show InChI InChI=1S/C26H35N3O5S/c1-16-23(22-20(31-3)10-19(14-30-2)11-21(22)32-4)29-26(35-16)24(25(27-29)33-5)28(12-17-6-7-17)13-18-8-9-34-15-18/h10-11,17-18H,6-9,12-15H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101721
(US8530504, 84)Show SMILES CCCN(CC1CCOC1)c1c(OCC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.09,6.63,;-3.6,6.23,;-3.2,4.74,;-1.72,4.34,;-.63,5.43,;.91,5.43,;1.82,4.18,;3.28,4.66,;3.28,6.2,;1.82,6.68,;-1.32,2.85,;-2.22,1.61,;-3.76,1.61,;-4.53,.27,;-6.07,.27,;-1.32,.36,;.15,.84,;1.61,.36,;2.52,1.61,;1.61,2.85,;.15,2.38,;2.01,-1.13,;.92,-2.21,;-.57,-1.82,;-1.66,-2.9,;1.32,-3.7,;2.81,-4.1,;3.21,-5.59,;2.12,-6.68,;.63,-6.28,;3.9,-3.01,;3.5,-1.52,;4.59,-.43,;6.07,-.83,)| Show InChI InChI=1S/C25H35N3O5S/c1-6-9-27(13-17-8-10-32-15-17)23-24(33-7-2)26-28-19(16-34-25(23)28)22-20(30-4)11-18(14-29-3)12-21(22)31-5/h11-12,16-17H,6-10,13-15H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101653
(US8530504, 14)Show SMILES CCCN(C1CCOC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(1.76,6.36,;.67,5.27,;-.82,5.67,;-1.91,4.58,;-3.39,4.98,;-4.64,4.07,;-5.88,4.98,;-5.41,6.44,;-3.87,6.44,;-1.51,3.09,;-2.41,1.84,;-3.95,1.84,;-4.72,.51,;-1.51,.6,;-.04,1.07,;1.42,.6,;2.33,1.84,;1.42,3.09,;-.04,2.61,;1.82,-.89,;3.31,-1.29,;4.4,-.2,;5.88,-.6,;3.71,-2.78,;2.62,-3.86,;3.02,-5.35,;1.93,-6.44,;.44,-6.04,;1.13,-3.47,;.73,-1.98,;-.76,-1.58,;-1.84,-2.67,)| Show InChI InChI=1S/C23H31N3O5S/c1-6-8-25(16-7-9-31-13-16)21-22(30-5)24-26-17(14-32-23(21)26)20-18(28-3)10-15(12-27-2)11-19(20)29-4/h10-11,14,16H,6-9,12-13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101658
(US8530504, 19)Show SMILES COC(C)c1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 |(5.09,-5.42,;4,-6.51,;2.51,-6.11,;1.43,-7.2,;2.12,-4.62,;.63,-4.22,;.23,-2.73,;-1.26,-2.33,;-2.35,-3.42,;1.32,-1.64,;.92,-.16,;1.83,1.09,;.92,2.33,;-.54,1.86,;-2.01,2.33,;-2.41,3.82,;-3.9,4.22,;-4.29,5.71,;-3.9,7.2,;-5.38,6.8,;-1.32,4.91,;.17,4.51,;.64,3.05,;2.18,3.05,;2.66,4.51,;1.41,5.42,;-2.91,1.09,;-4.45,1.09,;-5.22,-.24,;-2.01,-.16,;-.54,.32,;2.81,-2.04,;3.9,-.95,;5.38,-1.35,;3.2,-3.53,)| Show InChI InChI=1S/C26H35N3O5S/c1-16(30-2)19-10-21(31-3)23(22(11-19)32-4)20-15-35-26-24(25(33-5)27-29(20)26)28(12-17-6-7-17)13-18-8-9-34-14-18/h10-11,15-18H,6-9,12-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101726
(US8530504, 89)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CC4)c4cccnc4)c(OC)nn23)c(OC)c1 |(.68,-6.25,;2.17,-6.65,;3.26,-5.56,;2.86,-4.08,;3.95,-2.99,;3.55,-1.5,;4.64,-.41,;6.13,-.81,;2.06,-1.1,;1.66,.39,;2.57,1.63,;1.66,2.88,;.2,2.4,;-1.27,2.88,;-1.66,4.37,;-.57,5.46,;.91,5.06,;2,3.97,;2.4,5.46,;-3.15,4.77,;-4.24,3.68,;-5.73,4.08,;-6.13,5.56,;-5.04,6.65,;-3.55,6.25,;-2.17,1.63,;-3.71,1.63,;-4.48,.3,;-1.27,.39,;.2,.86,;.97,-2.19,;-.51,-1.79,;-1.6,-2.88,;1.37,-3.68,)| Show InChI InChI=1S/C25H28N4O4S/c1-30-14-17-10-20(31-2)22(21(11-17)32-3)19-15-34-25-23(24(33-4)27-29(19)25)28(13-16-7-8-16)18-6-5-9-26-12-18/h5-6,9-12,15-16H,7-8,13-14H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101712
(US8530504, 74)Show SMILES COCCN(C1CCCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(cc1OC)C#N |(-5.88,7.56,;-5.48,6.07,;-3.99,5.68,;-3.59,4.19,;-2.1,3.79,;-1.02,4.88,;.52,4.88,;1,6.34,;-.25,7.25,;-1.49,6.34,;-1.52,2.37,;-2.42,1.12,;-3.96,1.12,;-4.73,-.21,;-1.52,-.12,;-.05,.35,;1.41,-.12,;2.32,1.12,;1.41,2.37,;-.05,1.89,;1.81,-1.61,;.72,-2.7,;-.76,-2.3,;-1.85,-3.39,;1.12,-4.19,;2.61,-4.59,;3.7,-3.5,;3.3,-2.01,;4.39,-.92,;5.88,-1.32,;3.01,-6.07,;3.41,-7.56,)| Show InChI InChI=1S/C23H28N4O4S/c1-28-10-9-26(16-7-5-6-8-16)21-22(31-4)25-27-17(14-32-23(21)27)20-18(29-2)11-15(13-24)12-19(20)30-3/h11-12,14,16H,5-10H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101705
(US8530504, 67)Show SMILES COCc1cc(OC)c(-c2csc3c(N(C4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 |(5.58,-5.85,;4.5,-6.94,;3.01,-6.54,;2.61,-5.05,;1.12,-4.65,;.72,-3.17,;-.76,-2.77,;-1.85,-3.86,;1.81,-2.08,;1.41,-.59,;2.32,.66,;1.41,1.9,;-.05,1.43,;-1.52,1.9,;-2.29,3.24,;-3.77,3.63,;-4.54,4.97,;-5.88,4.2,;-5.11,2.86,;-1.52,4.57,;.02,4.57,;.5,6.03,;-.75,6.94,;-1.99,6.03,;-2.42,.66,;-3.96,.66,;-4.73,-.68,;-1.52,-.59,;-.05,-.11,;3.3,-2.48,;4.39,-1.39,;5.88,-1.79,;3.7,-3.96,)| Show InChI InChI=1S/C24H31N3O5S/c1-28-12-15-10-19(29-2)21(20(11-15)30-3)18-14-33-24-22(23(31-4)25-27(18)24)26(16-6-5-7-16)17-8-9-32-13-17/h10-11,14,16-17H,5-9,12-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101682
(US8530504, 44)Show SMILES CCCN(Cc1ccncc1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.58,6.58,;-4.09,6.18,;-3.7,4.7,;-2.21,4.3,;-1.12,5.39,;.42,5.39,;1.19,4.05,;2.73,4.05,;3.5,5.39,;2.73,6.72,;1.19,6.72,;-1.81,2.81,;-2.72,1.56,;-4.26,1.56,;-5.03,.23,;-1.81,.32,;-.35,.79,;1.12,.32,;2.02,1.56,;1.12,2.81,;-.35,2.33,;1.52,-1.17,;3.01,-1.57,;4.09,-.48,;5.58,-.88,;3.4,-3.05,;2.32,-4.14,;2.71,-5.63,;1.62,-6.72,;.14,-6.32,;.83,-3.75,;.43,-2.26,;-1.06,-1.86,;-2.15,-2.95,)| Show InChI InChI=1S/C25H30N4O4S/c1-6-11-28(14-17-7-9-26-10-8-17)23-24(33-5)27-29-19(16-34-25(23)29)22-20(31-3)12-18(15-30-2)13-21(22)32-4/h7-10,12-13,16H,6,11,14-15H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101725
(US8530504, 88)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CCCF)c4cccnc4)c(OC)nn23)c(OC)c1 |(.68,-6.25,;2.17,-6.65,;3.26,-5.56,;2.86,-4.08,;1.37,-3.68,;.97,-2.19,;-.51,-1.79,;-1.6,-2.88,;2.06,-1.1,;1.66,.39,;2.57,1.63,;1.66,2.88,;.2,2.4,;-1.27,2.88,;-1.66,4.37,;-.57,5.46,;.91,5.06,;2,6.15,;3.49,5.75,;-3.15,4.77,;-4.24,3.68,;-5.73,4.08,;-6.13,5.56,;-5.04,6.65,;-3.55,6.25,;-2.17,1.63,;-3.71,1.63,;-4.48,.3,;-1.27,.39,;.2,.86,;3.55,-1.5,;4.64,-.41,;6.13,-.81,;3.95,-2.99,)| Show InChI InChI=1S/C24H27FN4O4S/c1-30-14-16-11-19(31-2)21(20(12-16)32-3)18-15-34-24-22(23(33-4)27-29(18)24)28(10-6-8-25)17-7-5-9-26-13-17/h5,7,9,11-13,15H,6,8,10,14H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101652
(US8530504, 13)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CC4CC4)C4CCOC4)c(OC)nn23)c(OC)c1 |(.44,-6.04,;1.93,-6.44,;3.02,-5.35,;2.62,-3.86,;1.13,-3.47,;.73,-1.98,;-.76,-1.58,;-1.84,-2.67,;1.82,-.89,;1.42,.6,;2.33,1.84,;1.42,3.09,;-.04,2.61,;-1.51,3.09,;-1.91,4.58,;-.82,5.67,;.67,5.27,;1.76,4.18,;2.16,5.67,;-3.39,4.98,;-4.64,4.07,;-5.88,4.98,;-5.41,6.44,;-3.87,6.44,;-2.41,1.84,;-3.95,1.84,;-4.72,.51,;-1.51,.6,;-.04,1.07,;3.31,-1.29,;4.4,-.2,;5.88,-.6,;3.71,-2.78,)| Show InChI InChI=1S/C24H31N3O5S/c1-28-12-16-9-19(29-2)21(20(10-16)30-3)18-14-33-24-22(23(31-4)25-27(18)24)26(11-15-5-6-15)17-7-8-32-13-17/h9-10,14-15,17H,5-8,11-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101656
(US8530504, 17)Show SMILES CCCN(C1CCOCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(C)cc1OC |(2,5.6,;.91,4.51,;-.57,4.91,;-1.66,3.82,;-3.15,4.22,;-3.55,5.71,;-5.04,6.11,;-6.13,5.02,;-5.73,3.53,;-4.24,3.13,;-1.27,2.33,;-2.17,1.09,;-3.71,1.09,;-4.48,-.24,;-1.27,-.16,;.2,.32,;1.66,-.16,;2.57,1.09,;1.66,2.33,;.2,1.86,;2.06,-1.64,;.97,-2.73,;-.51,-2.33,;-1.6,-3.42,;1.37,-4.22,;2.86,-4.62,;3.26,-6.11,;3.95,-3.53,;3.55,-2.04,;4.64,-.95,;6.13,-1.35,)| Show InChI InChI=1S/C23H31N3O4S/c1-6-9-25(16-7-10-30-11-8-16)21-22(29-5)24-26-17(14-31-23(21)26)20-18(27-3)12-15(2)13-19(20)28-4/h12-14,16H,6-11H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101670
(US8530504, 32)Show SMILES COCCCN(CC1CC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(4.38,7.49,;3.29,6.4,;1.8,6.8,;.71,5.71,;-.77,6.11,;-1.86,5.02,;-3.35,5.42,;-4.44,4.33,;-5.93,3.93,;-4.84,2.84,;-1.46,3.53,;-2.37,2.28,;-3.91,2.28,;-4.68,.95,;-1.46,1.04,;,1.51,;1.46,1.04,;2.37,2.28,;1.46,3.53,;,3.05,;1.86,-.45,;3.35,-.85,;4.44,.24,;5.93,-.16,;3.75,-2.33,;2.66,-3.42,;3.06,-4.91,;1.97,-6,;2.37,-7.49,;1.17,-3.03,;.77,-1.54,;-.71,-1.14,;-1.8,-2.23,)| Show InChI InChI=1S/C24H33N3O5S/c1-28-10-6-9-26(13-16-7-8-16)22-23(32-5)25-27-18(15-33-24(22)27)21-19(30-3)11-17(14-29-2)12-20(21)31-4/h11-12,15-16H,6-10,13-14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101677
(US8530504, 39)Show SMILES CCCN(CCCOC)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.93,4.73,;-4.44,4.33,;-3.35,5.42,;-1.86,5.02,;-.77,6.11,;.71,5.71,;1.8,6.8,;3.29,6.4,;4.38,7.49,;-1.46,3.53,;-2.37,2.28,;-3.91,2.28,;-4.68,.95,;-1.46,1.04,;,1.51,;1.46,1.04,;2.37,2.28,;1.46,3.53,;,3.05,;1.86,-.45,;.77,-1.54,;-.71,-1.14,;-1.8,-2.23,;1.17,-3.03,;2.66,-3.42,;3.06,-4.91,;1.97,-6,;2.37,-7.49,;3.75,-2.33,;3.35,-.85,;4.44,.24,;5.93,-.16,)| Show InChI InChI=1S/C23H33N3O5S/c1-7-9-25(10-8-11-27-2)21-22(31-6)24-26-17(15-32-23(21)26)20-18(29-4)12-16(14-28-3)13-19(20)30-5/h12-13,15H,7-11,14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101709
(US8530504, 71)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4cccnc4)c(OC)nn23)c(OC)c1 |(.34,-7.54,;1.82,-7.94,;2.91,-6.85,;2.51,-5.36,;1.03,-4.96,;.63,-3.48,;-.86,-3.08,;-1.95,-4.17,;1.72,-2.39,;1.32,-.9,;2.22,.35,;1.32,1.59,;-.15,1.12,;-1.61,1.59,;-2.01,3.08,;-.92,4.17,;.57,3.77,;1.66,4.86,;3.14,4.46,;-3.5,3.48,;-3.9,4.96,;-2.81,6.05,;-3.2,7.54,;-4.69,7.94,;-5.78,6.85,;-5.38,5.36,;-2.52,.35,;-4.06,.35,;-4.83,-.99,;-1.61,-.9,;-.15,-.42,;3.2,-2.79,;4.29,-1.7,;5.78,-2.1,;3.6,-4.27,)| Show InChI InChI=1S/C25H29FN4O4S/c1-31-15-18-11-20(32-2)22(21(12-18)33-3)19-16-35-25-23(24(34-4)28-30(19)25)29(10-6-8-26)14-17-7-5-9-27-13-17/h5,7,9,11-13,16H,6,8,10,14-15H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM101687
(US8530504, 49)Show SMILES COCc1cc(OC)c(-c2csc3c(N(CCOC(C)C)CC4CC4)c(OC)nn23)c(OC)c1 |(6.92,-4.62,;5.83,-5.71,;4.35,-5.31,;3.95,-3.82,;5.04,-2.73,;4.64,-1.25,;5.73,-.16,;7.22,-.56,;3.15,-.85,;2.75,.64,;3.66,1.89,;2.75,3.13,;1.29,2.66,;-.18,3.13,;-.57,4.62,;-2.06,5.02,;-3.15,3.93,;-4.64,4.33,;-5.73,3.24,;-7.22,3.64,;-5.33,1.75,;.51,5.71,;2,5.31,;3.09,4.22,;3.49,5.71,;-1.08,1.89,;-2.62,1.89,;-3.39,.55,;-.18,.64,;1.29,1.12,;2.06,-1.94,;.57,-1.54,;-.51,-2.63,;2.46,-3.42,)| Show InChI InChI=1S/C25H35N3O5S/c1-16(2)33-10-9-27(13-17-7-8-17)23-24(32-6)26-28-19(15-34-25(23)28)22-20(30-4)11-18(14-29-3)12-21(22)31-5/h11-12,15-17H,7-10,13-14H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Eisai R&D Management Co., Ltd.
US Patent
| Assay Description
A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate. |
US Patent US8530504 (2013)
BindingDB Entry DOI: 10.7270/Q29885NS |
More data for this
Ligand-Target Pair | |
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