Found 108 hits with Last Name = 'katsumata' and Initial = 's' 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)) | BDBM50087713
((1-Ethyl-propyl)-[3-(4-methoxy-2-methyl-phenyl)-2,...)Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(OC)cc1C |(-4.03,1.25,;-2.68,.48,;-1.35,1.27,;-1.37,2.81,;-2.86,3.21,;-.02,.5,;-.02,-1.04,;-1.34,-1.81,;-1.34,-3.35,;-2.66,-4.12,;,-4.12,;1.33,-3.35,;2.8,-3.8,;3.7,-2.55,;5.24,-2.53,;2.77,-1.32,;1.33,-1.81,;3.3,-5.26,;2.28,-6.39,;2.77,-7.87,;4.28,-8.16,;4.78,-9.63,;3.76,-10.79,;5.3,-7,;4.79,-5.55,;5.82,-4.4,)| Show InChI InChI=1S/C21H28N4O/c1-7-16(8-2)23-19-12-14(4)22-21-20(15(5)24-25(19)21)18-10-9-17(26-6)11-13(18)3/h9-12,16,23H,7-8H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354028
(CHEMBL1830524)Show InChI InChI=1S/C22H27N5O/c1-5-15-14-17(28-4)8-9-19(15)24-21-18-11-13-26(16(6-2)7-3)22(18)27-20(25-21)10-12-23-27/h8-14,16H,5-7H2,1-4H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351393
(CHEMBL1819083)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC(F)F)cc1Cl |(46.52,-30.65,;45.17,-31.39,;45.14,-32.93,;46.46,-33.73,;47.81,-32.98,;43.79,-33.68,;43.76,-35.22,;42.41,-35.96,;40.95,-35.46,;40.02,-36.69,;40.91,-37.95,;42.38,-37.51,;43.7,-38.3,;45.06,-37.54,;46.52,-38.04,;47.44,-36.8,;48.98,-36.82,;46.55,-35.55,;45.08,-36.01,;46.98,-39.51,;45.93,-40.64,;46.39,-42.1,;47.89,-42.44,;48.35,-43.91,;47.31,-45.05,;47.77,-46.52,;45.81,-44.71,;48.94,-41.3,;48.47,-39.84,;49.51,-38.7,)| Show InChI InChI=1S/C22H25ClF2N4O/c1-4-13(5-2)26-20-16-7-6-8-18(16)27-21-19(12(3)28-29(20)21)15-10-9-14(11-17(15)23)30-22(24)25/h9-11,13,22,26H,4-8H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354027
(CHEMBL1830523)Show InChI InChI=1S/C20H22ClN5O/c1-4-13(5-2)25-11-9-15-19(24-18-8-10-22-26(18)20(15)25)23-17-7-6-14(27-3)12-16(17)21/h6-13H,4-5H2,1-3H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351387
(CHEMBL1819077)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(23.48,-13.44,;22.13,-14.18,;22.1,-15.72,;23.42,-16.52,;24.77,-15.77,;20.75,-16.47,;20.72,-18.01,;19.37,-18.75,;17.91,-18.25,;16.98,-19.48,;17.87,-20.74,;19.34,-20.29,;20.67,-21.09,;22.02,-20.33,;23.48,-20.82,;24.4,-19.59,;25.94,-19.61,;23.51,-18.34,;22.04,-18.8,;23.94,-22.29,;22.89,-23.42,;23.35,-24.89,;24.85,-25.23,;25.31,-26.7,;24.27,-27.83,;25.9,-24.09,;25.44,-22.62,;26.47,-21.49,)| Show InChI InChI=1S/C22H27ClN4O/c1-5-14(6-2)24-21-17-8-7-9-19(17)25-22-20(13(3)26-27(21)22)16-11-10-15(28-4)12-18(16)23/h10-12,14,24H,5-9H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354036
(CHEMBL1828890)Show SMILES CCCN(CCC)c1c(CC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 Show InChI InChI=1S/C21H28ClN5O/c1-5-12-26(13-6-2)21-16(7-3)20(25-19-10-11-23-27(19)21)24-18-9-8-15(28-4)14-17(18)22/h8-11,14H,5-7,12-13H2,1-4H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354015
(CHEMBL1828900)Show SMILES CCCN(CCC)c1cc(nc2ccnn12)N(CC=C)c1ccc(OC)cc1Cl Show InChI InChI=1S/C22H28ClN5O/c1-5-12-26(13-6-2)22-16-21(25-20-10-11-24-28(20)22)27(14-7-3)19-9-8-17(29-4)15-18(19)23/h7-11,15-16H,3,5-6,12-14H2,1-2,4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354029
(CHEMBL1830525)Show InChI InChI=1S/C21H24ClN5/c1-4-14-13-15(22)7-8-18(14)24-20-17-10-12-26(16(5-2)6-3)21(17)27-19(25-20)9-11-23-27/h7-13,16H,4-6H2,1-3H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351394
(CHEMBL1819084)Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(-1.48,5.16,;-2.83,4.41,;-2.86,2.87,;-1.54,2.08,;-.19,2.83,;-4.2,2.13,;-4.23,.59,;-5.59,-.15,;-5.61,-1.7,;-6.96,-2.44,;-4.29,-2.55,;-2.93,-1.74,;-1.48,-2.23,;-.56,-1,;.98,-1.01,;-1.45,.26,;-2.92,-.2,;-1.02,-3.7,;-2.07,-4.83,;-1.61,-6.3,;-.1,-6.63,;.36,-8.1,;-.69,-9.24,;.94,-5.49,;.48,-4.03,;1.52,-2.89,)| Show InChI InChI=1S/C20H25ClN4O/c1-6-14(7-2)23-18-10-12(3)22-20-19(13(4)24-25(18)20)16-9-8-15(26-5)11-17(16)21/h8-11,14,23H,6-7H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354038
(CHEMBL1830527)Show SMILES CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc3ccnn3c12 Show InChI InChI=1S/C22H27N5/c1-6-17(7-2)26-11-9-18-21(24-19-8-10-23-27(19)22(18)26)25-20-15(4)12-14(3)13-16(20)5/h8-13,17H,6-7H2,1-5H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354031
(CHEMBL1830528)Show InChI InChI=1S/C22H26N4O2/c1-5-15-8-9-18(19(14-15)27-4)28-21-17-11-13-25(16(6-2)7-3)22(17)26-20(24-21)10-12-23-26/h8-14,16H,5-7H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351396
(CHEMBL1819086)Show SMILES CCC(CC)Nc1c2OCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(27.95,4.87,;26.6,4.13,;26.57,2.59,;27.89,1.79,;29.24,2.54,;25.23,1.84,;25.2,.3,;23.85,-.44,;22.39,.06,;21.46,-1.17,;22.34,-2.43,;23.82,-1.98,;25.14,-2.78,;26.5,-2.02,;27.95,-2.52,;28.87,-1.28,;30.41,-1.3,;27.98,-.03,;26.52,-.49,;28.41,-3.99,;27.37,-5.11,;27.82,-6.58,;29.33,-6.92,;29.79,-8.39,;28.74,-9.53,;30.37,-5.78,;29.91,-4.32,;30.95,-3.18,)| Show InChI InChI=1S/C21H25ClN4O2/c1-5-13(6-2)23-21-19-17(9-10-28-19)24-20-18(12(3)25-26(20)21)15-8-7-14(27-4)11-16(15)22/h7-8,11,13,23H,5-6,9-10H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Rattus norvegicus (rat)) | BDBM50351387
(CHEMBL1819077)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(23.48,-13.44,;22.13,-14.18,;22.1,-15.72,;23.42,-16.52,;24.77,-15.77,;20.75,-16.47,;20.72,-18.01,;19.37,-18.75,;17.91,-18.25,;16.98,-19.48,;17.87,-20.74,;19.34,-20.29,;20.67,-21.09,;22.02,-20.33,;23.48,-20.82,;24.4,-19.59,;25.94,-19.61,;23.51,-18.34,;22.04,-18.8,;23.94,-22.29,;22.89,-23.42,;23.35,-24.89,;24.85,-25.23,;25.31,-26.7,;24.27,-27.83,;25.9,-24.09,;25.44,-22.62,;26.47,-21.49,)| Show InChI InChI=1S/C22H27ClN4O/c1-5-14(6-2)24-21-17-8-7-9-19(17)25-22-20(13(3)26-27(21)22)16-11-10-15(28-4)12-18(16)23/h10-12,14,24H,5-9H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from corticotropin-releasing factor receptor 1 in rat brain membranes after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354030
(CHEMBL1830526)Show SMILES CCC(CC)n1ccc2c(Cc3c(C)cc(C)cc3C)nc3ccnn3c12 Show InChI InChI=1S/C23H28N4/c1-6-18(7-2)26-11-9-19-21(25-22-8-10-24-27(22)23(19)26)14-20-16(4)12-15(3)13-17(20)5/h8-13,18H,6-7,14H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354033
(CHEMBL1828887)Show InChI InChI=1S/C19H24ClN5O/c1-5-13(6-2)22-19-12(3)18(24-17-9-10-21-25(17)19)23-16-8-7-14(26-4)11-15(16)20/h7-11,13,22H,5-6H2,1-4H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354035
(CHEMBL1828889)Show InChI InChI=1S/C20H26ClN5O/c1-5-11-25(12-6-2)20-14(3)19(24-18-9-10-22-26(18)20)23-17-8-7-15(27-4)13-16(17)21/h7-10,13H,5-6,11-12H2,1-4H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354021
(CHEMBL1830517)Show InChI InChI=1S/C19H25ClN6O/c1-5-9-25(10-6-2)18-13(3)17(24-19-21-12-22-26(18)19)23-16-8-7-14(27-4)11-15(16)20/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,21,22,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351386
(CHEMBL1819076)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1c(C)cc(OC)cc1C |(11.43,-13.22,;10.08,-13.96,;10.05,-15.5,;11.37,-16.3,;12.72,-15.55,;8.71,-16.25,;8.68,-17.79,;7.33,-18.53,;5.87,-18.03,;4.94,-19.26,;5.82,-20.52,;7.3,-20.08,;8.62,-20.87,;9.98,-20.11,;11.43,-20.61,;12.35,-19.37,;13.89,-19.39,;11.46,-18.12,;10,-18.58,;11.89,-22.08,;13.39,-22.41,;14.43,-21.27,;13.85,-23.87,;12.81,-25.01,;13.27,-26.48,;12.22,-27.62,;11.3,-24.67,;10.85,-23.21,;9.34,-22.87,)| Show InChI InChI=1S/C24H32N4O/c1-7-17(8-2)25-23-19-10-9-11-20(19)26-24-22(16(5)27-28(23)24)21-14(3)12-18(29-6)13-15(21)4/h12-13,17,25H,7-11H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50087713
((1-Ethyl-propyl)-[3-(4-methoxy-2-methyl-phenyl)-2,...)Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(OC)cc1C |(-4.03,1.25,;-2.68,.48,;-1.35,1.27,;-1.37,2.81,;-2.86,3.21,;-.02,.5,;-.02,-1.04,;-1.34,-1.81,;-1.34,-3.35,;-2.66,-4.12,;,-4.12,;1.33,-3.35,;2.8,-3.8,;3.7,-2.55,;5.24,-2.53,;2.77,-1.32,;1.33,-1.81,;3.3,-5.26,;2.28,-6.39,;2.77,-7.87,;4.28,-8.16,;4.78,-9.63,;3.76,-10.79,;5.3,-7,;4.79,-5.55,;5.82,-4.4,)| Show InChI InChI=1S/C21H28N4O/c1-7-16(8-2)23-19-12-14(4)22-21-20(15(5)24-25(19)21)18-10-9-17(26-6)11-13(18)3/h9-12,16,23H,7-8H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Antagonist activity at human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells assessed as inhibition of CRF-induced cAMP productio... |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354023
(CHEMBL1830519)Show InChI InChI=1S/C20H26ClN5O/c1-5-10-25(11-6-2)19-14(3)18(24-20-22-9-12-26(19)20)23-17-8-7-15(27-4)13-16(17)21/h7-9,12-13H,5-6,10-11H2,1-4H3,(H,22,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354010
(CHEMBL1828895)Show SMILES CCCN(CCC)c1c(OC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 Show InChI InChI=1S/C20H26ClN5O2/c1-5-11-25(12-6-2)20-18(28-4)19(24-17-9-10-22-26(17)20)23-16-8-7-14(27-3)13-15(16)21/h7-10,13H,5-6,11-12H2,1-4H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354032
(CHEMBL1828886)Show InChI InChI=1S/C18H22ClN5O/c1-4-12(5-2)21-18-11-16(23-17-8-9-20-24(17)18)22-15-7-6-13(25-3)10-14(15)19/h6-12,21H,4-5H2,1-3H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354018
(CHEMBL1830514)Show SMILES CCCN(CCC)c1cc(nc2ccnn12)N(COC)c1ccc(OC)cc1Cl Show InChI InChI=1S/C21H28ClN5O2/c1-5-11-25(12-6-2)21-14-20(24-19-9-10-23-27(19)21)26(15-28-3)18-8-7-16(29-4)13-17(18)22/h7-10,13-14H,5-6,11-12,15H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351391
(CHEMBL1819081)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC(F)(F)F)cc1Cl |(22.39,-31.23,;21.04,-31.98,;21.01,-33.52,;22.33,-34.31,;23.68,-33.57,;19.67,-34.26,;19.64,-35.8,;18.28,-36.55,;16.83,-36.04,;15.9,-37.27,;16.78,-38.54,;18.26,-38.09,;19.58,-38.89,;20.94,-38.13,;22.39,-38.62,;23.31,-37.39,;24.85,-37.41,;22.42,-36.13,;20.95,-36.59,;22.85,-40.09,;21.8,-41.22,;22.26,-42.69,;23.77,-43.03,;24.23,-44.5,;23.18,-45.63,;23.64,-47.1,;21.68,-45.29,;22.08,-46.71,;24.81,-41.89,;24.35,-40.42,;25.39,-39.28,)| Show InChI InChI=1S/C22H24ClF3N4O/c1-4-13(5-2)27-20-16-7-6-8-18(16)28-21-19(12(3)29-30(20)21)15-10-9-14(11-17(15)23)31-22(24,25)26/h9-11,13,27H,4-8H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354019
(CHEMBL1830515)Show InChI InChI=1S/C18H23ClN6O/c1-5-12(6-2)22-17-11(3)16(24-18-20-10-21-25(17)18)23-15-8-7-13(26-4)9-14(15)19/h7-10,12,22H,5-6H2,1-4H3,(H,20,21,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354011
(CHEMBL1828896)Show InChI InChI=1S/C20H26ClN5O/c1-5-11-25(12-6-2)20-14-19(23-18-9-10-22-26(18)20)24(3)17-8-7-15(27-4)13-16(17)21/h7-10,13-14H,5-6,11-12H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354026
(CHEMBL1830522)Show InChI InChI=1S/C19H25ClN6O/c1-5-11-25(12-6-2)19-23-18(22-17-9-10-21-26(17)19)24(3)16-8-7-14(27-4)13-15(16)20/h7-10,13H,5-6,11-12H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351397
(CHEMBL1819087)Show SMILES CCC(CC)Nc1c2COCc2nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(-.65,-11.56,;-2,-12.31,;-2.02,-13.85,;-.71,-14.64,;.64,-13.9,;-3.37,-14.59,;-3.4,-16.13,;-4.75,-16.88,;-6.21,-16.37,;-7.14,-17.6,;-6.26,-18.87,;-4.78,-18.42,;-3.4,-19.27,;-2.1,-18.46,;-.65,-18.95,;.27,-17.72,;1.81,-17.74,;-.62,-16.46,;-2.08,-16.92,;-.19,-20.42,;-1.23,-21.55,;-.78,-23.02,;.73,-23.36,;1.19,-24.83,;.15,-25.96,;1.77,-22.22,;1.31,-20.75,;2.35,-19.61,)| Show InChI InChI=1S/C21H25ClN4O2/c1-5-13(6-2)23-20-16-10-28-11-18(16)24-21-19(12(3)25-26(20)21)15-8-7-14(27-4)9-17(15)22/h7-9,13,23H,5-6,10-11H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351385
(CHEMBL1819075)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1cc(C)c(OC)cc1C |(-1.74,-12.88,;-3.09,-13.63,;-3.12,-15.17,;-1.8,-15.96,;-.45,-15.22,;-4.47,-15.91,;-4.5,-17.45,;-5.85,-18.2,;-7.31,-17.69,;-8.24,-18.93,;-7.35,-20.19,;-5.88,-19.74,;-4.56,-20.54,;-3.2,-19.78,;-1.74,-20.27,;-.83,-19.04,;.71,-19.06,;-1.71,-17.79,;-3.18,-18.24,;-1.28,-21.74,;-2.33,-22.87,;-1.87,-24.34,;-2.92,-25.47,;-.37,-24.68,;.09,-26.15,;-.95,-27.28,;.68,-23.54,;.21,-22.07,;1.25,-20.94,)| Show InChI InChI=1S/C24H32N4O/c1-7-17(8-2)25-23-18-10-9-11-20(18)26-24-22(16(5)27-28(23)24)19-12-15(4)21(29-6)13-14(19)3/h12-13,17,25H,7-11H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351371
(CHEMBL1819061)Show SMILES CCC(CC)Nc1c2OCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1C |(13.98,4.51,;12.63,3.77,;12.61,2.23,;13.92,1.43,;15.27,2.18,;11.26,1.48,;11.23,-.06,;9.88,-.8,;8.42,-.3,;7.49,-1.53,;8.37,-2.79,;9.85,-2.34,;11.17,-3.14,;12.53,-2.38,;13.98,-2.87,;14.9,-1.64,;16.44,-1.66,;14.01,-.39,;12.55,-.85,;14.44,-4.34,;13.4,-5.47,;13.85,-6.94,;15.36,-7.28,;15.82,-8.75,;14.78,-9.88,;16.4,-6.14,;15.94,-4.67,;16.98,-3.54,)| Show InChI InChI=1S/C22H28N4O2/c1-6-15(7-2)23-22-20-18(10-11-28-20)24-21-19(14(4)25-26(21)22)17-9-8-16(27-5)12-13(17)3/h8-9,12,15,23H,6-7,10-11H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354012
(CHEMBL1828897)Show SMILES CCCN(CCC)c1cc(nc2ccnn12)N(CC)c1ccc(OC)cc1Cl Show InChI InChI=1S/C21H28ClN5O/c1-5-12-25(13-6-2)21-15-20(24-19-10-11-23-27(19)21)26(7-3)18-9-8-16(28-4)14-17(18)22/h8-11,14-15H,5-7,12-13H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 31.6 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354037
(CHEMBL1828891)Show SMILES CCCN(CCC)c1c(CCC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 Show InChI InChI=1S/C22H30ClN5O/c1-5-8-17-21(25-19-10-9-16(29-4)15-18(19)23)26-20-11-12-24-28(20)22(17)27(13-6-2)14-7-3/h9-12,15H,5-8,13-14H2,1-4H3,(H,25,26) | 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 |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354022
(CHEMBL1830518)Show InChI InChI=1S/C19H25ClN6O/c1-5-9-25(10-6-2)18-12-17(23-19-21-13-22-26(18)19)24(3)16-8-7-14(27-4)11-15(16)20/h7-8,11-13H,5-6,9-10H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351374
(CHEMBL1819064)Show SMILES CCC(CC)Nc1c2COCc2nc2c(c(C)nn12)-c1ccc(OC)cc1C |(15.25,-13.3,;13.9,-14.05,;13.87,-15.59,;15.19,-16.38,;16.54,-15.64,;12.53,-16.33,;12.5,-17.87,;11.14,-18.62,;9.69,-18.11,;8.76,-19.35,;9.64,-20.61,;11.12,-20.16,;12.44,-20.96,;13.8,-20.2,;15.25,-20.69,;16.17,-19.46,;17.71,-19.48,;15.28,-18.21,;13.81,-18.66,;15.71,-22.16,;14.66,-23.29,;15.12,-24.76,;16.63,-25.1,;17.09,-26.57,;16.04,-27.7,;17.67,-23.96,;17.21,-22.49,;18.25,-21.36,)| Show InChI InChI=1S/C22H28N4O2/c1-6-15(7-2)23-21-18-11-28-12-19(18)24-22-20(14(4)25-26(21)22)17-9-8-16(27-5)10-13(17)3/h8-10,15,23H,6-7,11-12H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351370
(CHEMBL1819060)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1C |(-2.08,4.74,;-3.43,3.99,;-3.46,2.45,;-2.14,1.66,;-.79,2.41,;-4.8,1.71,;-4.83,.17,;-6.18,-.57,;-7.64,-.07,;-8.57,-1.3,;-7.69,-2.56,;-6.21,-2.12,;-4.89,-2.91,;-3.53,-2.16,;-2.08,-2.65,;-1.16,-1.42,;.38,-1.43,;-2.05,-.16,;-3.51,-.62,;-1.62,-4.12,;-2.66,-5.25,;-2.21,-6.72,;-.7,-7.05,;-.24,-8.52,;-1.29,-9.66,;.34,-5.91,;-.12,-4.45,;.92,-3.31,)| Show InChI InChI=1S/C23H30N4O/c1-6-16(7-2)24-22-19-9-8-10-20(19)25-23-21(15(4)26-27(22)23)18-12-11-17(28-5)13-14(18)3/h11-13,16,24H,6-10H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351392
(CHEMBL1819082)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(Cl)cc1Cl |(34.43,-32.02,;33.08,-32.76,;33.05,-34.3,;34.37,-35.1,;35.72,-34.35,;31.71,-35.05,;31.68,-36.59,;30.32,-37.33,;28.87,-36.83,;27.94,-38.06,;28.82,-39.32,;30.3,-38.87,;31.62,-39.67,;32.98,-38.91,;34.43,-39.41,;35.35,-38.17,;36.89,-38.19,;34.46,-36.92,;32.99,-37.38,;34.89,-40.88,;33.84,-42,;34.3,-43.47,;35.81,-43.81,;36.27,-45.28,;36.85,-42.67,;36.39,-41.21,;37.43,-40.07,)| Show InChI InChI=1S/C21H24Cl2N4/c1-4-14(5-2)24-20-16-7-6-8-18(16)25-21-19(12(3)26-27(20)21)15-10-9-13(22)11-17(15)23/h9-11,14,24H,4-8H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351375
(CHEMBL1819065)Show SMILES CCC(CC)Nc1c2CSCc2nc2c(c(C)nn12)-c1ccc(OC)cc1C |(31.02,-13.82,;29.68,-14.56,;29.65,-16.1,;30.97,-16.9,;32.31,-16.15,;28.3,-16.85,;28.27,-18.39,;26.92,-19.13,;25.46,-18.63,;24.53,-19.86,;25.41,-21.12,;26.89,-20.67,;28.21,-21.47,;29.57,-20.71,;31.02,-21.21,;31.94,-19.97,;33.48,-19.99,;31.05,-18.72,;29.59,-19.18,;31.48,-22.68,;30.44,-23.8,;30.9,-25.27,;32.4,-25.61,;32.86,-27.08,;31.82,-28.22,;33.44,-24.47,;32.98,-23.01,;34.02,-21.87,)| Show InChI InChI=1S/C22H28N4OS/c1-6-15(7-2)23-21-18-11-28-12-19(18)24-22-20(14(4)25-26(21)22)17-9-8-16(27-5)10-13(17)3/h8-10,15,23H,6-7,11-12H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351383
(CHEMBL1819073)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(cc1C)N(C)C |(26.44,3.99,;25.09,3.25,;25.07,1.71,;26.38,.91,;27.73,1.66,;23.72,.96,;23.69,-.58,;22.34,-1.32,;20.88,-.82,;19.95,-2.05,;20.83,-3.31,;22.31,-2.86,;23.63,-3.66,;24.99,-2.9,;26.44,-3.39,;27.36,-2.16,;28.9,-2.18,;26.47,-.91,;25.01,-1.37,;26.9,-4.86,;25.86,-5.99,;26.31,-7.46,;27.82,-7.8,;28.86,-6.66,;28.4,-5.2,;29.44,-4.06,;28.28,-9.27,;27.24,-10.4,;29.78,-9.61,)| Show InChI InChI=1S/C24H33N5/c1-7-17(8-2)25-23-20-10-9-11-21(20)26-24-22(16(4)27-29(23)24)19-13-12-18(28(5)6)14-15(19)3/h12-14,17,25H,7-11H2,1-6H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354025
(CHEMBL1830521)Show SMILES CCCN(CCC)c1cc(nc2nccn12)N(CC)c1ccc(OC)cc1Cl Show InChI InChI=1S/C21H28ClN5O/c1-5-11-25(12-6-2)20-15-19(24-21-23-10-13-27(20)21)26(7-3)18-9-8-16(28-4)14-17(18)22/h8-10,13-15H,5-7,11-12H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354020
(CHEMBL1830516)Show InChI InChI=1S/C18H23ClN6O/c1-5-12(6-2)22-17-10-16(23-18-20-11-21-25(17)18)24(3)15-8-7-13(26-4)9-14(15)19/h7-12,22H,5-6H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351388
(CHEMBL1819078)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1SC |(36.6,-14.42,;35.25,-15.17,;35.22,-16.71,;36.54,-17.5,;37.89,-16.76,;33.88,-17.45,;33.85,-18.99,;32.49,-19.74,;31.04,-19.23,;30.11,-20.47,;30.99,-21.73,;32.47,-21.28,;33.79,-22.08,;35.15,-21.32,;36.6,-21.81,;37.52,-20.58,;39.06,-20.6,;36.63,-19.33,;35.16,-19.78,;37.06,-23.28,;36.01,-24.41,;36.47,-25.88,;37.98,-26.22,;38.44,-27.69,;37.39,-28.82,;39.02,-25.08,;38.56,-23.61,;39.6,-22.48,;41.1,-22.81,)| Show InChI InChI=1S/C23H30N4OS/c1-6-15(7-2)24-22-17-9-8-10-19(17)25-23-21(14(3)26-27(22)23)18-12-11-16(28-4)13-20(18)29-5/h11-13,15,24H,6-10H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351395
(CHEMBL1819085)Show SMILES CCC(CC)Nc1c(C)c(C)nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(13.79,4.7,;12.44,3.96,;12.41,2.42,;13.73,1.62,;15.08,2.37,;11.06,1.67,;11.03,.13,;9.68,-.61,;8.36,.18,;9.65,-2.16,;8.31,-2.9,;10.98,-2.95,;12.33,-2.19,;13.79,-2.69,;14.71,-1.45,;16.25,-1.47,;13.82,-.2,;12.35,-.66,;14.25,-4.16,;13.2,-5.29,;13.66,-6.75,;15.16,-7.09,;15.62,-8.56,;14.58,-9.7,;16.21,-5.95,;15.75,-4.49,;16.79,-3.35,)| Show InChI InChI=1S/C21H27ClN4O/c1-7-15(8-2)24-20-12(3)13(4)23-21-19(14(5)25-26(20)21)17-10-9-16(27-6)11-18(17)22/h9-11,15,24H,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 | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351379
(CHEMBL1819069)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(nn12)C(F)(F)F)-c1ccc(OC)cc1C |(32.15,-30.33,;30.8,-31.08,;30.77,-32.62,;32.09,-33.41,;33.44,-32.66,;29.43,-33.36,;29.4,-34.9,;28.05,-35.64,;26.59,-35.14,;25.66,-36.37,;26.54,-37.63,;28.02,-37.19,;29.34,-37.98,;30.7,-37.23,;32.15,-37.72,;33.07,-36.49,;32.18,-35.23,;30.72,-35.69,;34.61,-36.5,;35.36,-37.85,;35.4,-35.18,;36.14,-36.5,;32.61,-39.19,;31.57,-40.32,;32.02,-41.79,;33.53,-42.12,;33.99,-43.59,;32.94,-44.73,;34.57,-40.98,;34.11,-39.52,;35.15,-38.38,)| Show InChI InChI=1S/C23H27F3N4O/c1-5-14(6-2)27-21-17-8-7-9-18(17)28-22-19(20(23(24,25)26)29-30(21)22)16-11-10-15(31-4)12-13(16)3/h10-12,14,27H,5-9H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354034
(CHEMBL1828888)Show InChI InChI=1S/C19H24ClN5O/c1-4-10-24(11-5-2)19-13-17(23-18-8-9-21-25(18)19)22-16-7-6-14(26-3)12-15(16)20/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 61 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354024
(CHEMBL1830520)Show InChI InChI=1S/C20H26ClN5O/c1-5-10-25(11-6-2)19-14-18(23-20-22-9-12-26(19)20)24(3)17-8-7-15(27-4)13-16(17)21/h7-9,12-14H,5-6,10-11H2,1-4H3 | 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 |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351390
(CHEMBL1819080)Show SMILES CCOc1ccc(-c2c(C)nn3c(NC(CC)CC)c4CCCc4nc23)c(Cl)c1 |(11.29,-47.27,;10.83,-45.8,;11.87,-44.67,;11.41,-43.2,;9.91,-42.86,;9.45,-41.39,;10.5,-40.26,;10.04,-38.79,;10.96,-37.56,;12.5,-37.58,;10.07,-36.31,;8.6,-36.76,;7.29,-35.97,;7.31,-34.43,;8.66,-33.69,;8.69,-32.15,;10.04,-31.4,;9.98,-34.48,;11.33,-33.74,;5.93,-36.72,;4.48,-36.21,;3.55,-37.44,;4.43,-38.71,;5.9,-38.26,;7.23,-39.06,;8.58,-38.3,;12,-40.59,;13.04,-39.46,;12.46,-42.06,)| Show InChI InChI=1S/C23H29ClN4O/c1-5-15(6-2)25-22-18-9-8-10-20(18)26-23-21(14(4)27-28(22)23)17-12-11-16(29-7-3)13-19(17)24/h11-13,15,25H,5-10H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 71 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351381
(CHEMBL1819071)Show SMILES CCC(CC)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccc(C)cc1C |(-1.88,4.93,;-3.22,4.18,;-3.25,2.64,;-1.93,1.85,;-.59,2.59,;-4.6,1.9,;-4.63,.36,;-5.98,-.39,;-7.44,.12,;-8.37,-1.11,;-7.49,-2.38,;-6.01,-1.93,;-4.69,-2.73,;-3.33,-1.97,;-1.88,-2.46,;-.96,-1.23,;.58,-1.25,;-1.85,.02,;-3.31,-.43,;-1.42,-3.93,;-2.46,-5.06,;-2,-6.53,;-.5,-6.87,;-.04,-8.34,;.54,-5.73,;.08,-4.26,;1.12,-3.13,)| Show InChI InChI=1S/C23H30N4/c1-6-17(7-2)24-22-19-9-8-10-20(19)25-23-21(16(5)26-27(22)23)18-12-11-14(3)13-15(18)4/h11-13,17,24H,6-10H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50354014
(CHEMBL1828899)Show SMILES CCCN(CCC)c1cc(nc2ccnn12)N(CC(C)=C)c1ccc(OC)cc1Cl Show InChI InChI=1S/C23H30ClN5O/c1-6-12-27(13-7-2)23-15-22(26-21-10-11-25-29(21)23)28(16-17(3)4)20-9-8-18(30-5)14-19(20)24/h8-11,14-15H,3,6-7,12-13,16H2,1-2,4-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 76.7 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]-CRF from human CRF1 receptor expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5955-66 (2011)
Article DOI: 10.1016/j.bmc.2011.08.055
BindingDB Entry DOI: 10.7270/Q24X5862 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351372
(CHEMBL1819062)Show SMILES CCC(CC)Nc1c2SCCc2nc2c(c(C)nn12)-c1ccc(OC)cc1C |(29.13,4.45,;27.79,3.71,;27.76,2.17,;29.08,1.37,;30.42,2.12,;26.41,1.42,;26.38,-.12,;25.03,-.86,;23.57,-.36,;22.64,-1.59,;23.52,-2.85,;25,-2.4,;26.32,-3.2,;27.68,-2.44,;29.13,-2.94,;30.05,-1.7,;31.59,-1.72,;29.16,-.45,;27.7,-.91,;29.59,-4.41,;28.55,-5.53,;29.01,-7,;30.51,-7.34,;30.97,-8.81,;29.93,-9.95,;31.55,-6.2,;31.09,-4.74,;32.13,-3.6,)| Show InChI InChI=1S/C22H28N4OS/c1-6-15(7-2)23-22-20-18(10-11-28-20)24-21-19(14(4)25-26(21)22)17-9-8-16(27-5)12-13(17)3/h8-9,12,15,23H,6-7,10-11H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50351398
(CHEMBL1819088)Show SMILES CCC(CC)Nc1c2CCOc2nc2c(c(C)nn12)-c1ccc(OC)cc1Cl |(15.19,-12.03,;13.84,-12.77,;13.81,-14.31,;15.13,-15.11,;16.48,-14.36,;12.46,-15.06,;12.43,-16.6,;11.08,-17.34,;9.62,-16.84,;8.69,-18.07,;9.58,-19.33,;11.05,-18.89,;12.38,-19.74,;13.73,-18.92,;15.19,-19.42,;16.11,-18.18,;17.65,-18.2,;15.22,-16.93,;13.75,-17.39,;15.65,-20.89,;14.6,-22.02,;15.06,-23.48,;16.56,-23.82,;17.02,-25.29,;15.98,-26.43,;17.61,-22.68,;17.15,-21.22,;18.19,-20.08,)| Show InChI InChI=1S/C21H25ClN4O2/c1-5-13(6-2)23-19-16-9-10-28-21(16)24-20-18(12(3)25-26(19)20)15-8-7-14(27-4)11-17(15)22/h7-8,11,13,23H,5-6,9-10H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 84 | n/a | n/a | n/a | n/a | n/a | n/a |
Minase Research Institute
Curated by ChEMBL
| Assay Description
Displacement of [125I]CRF from human corticotropin-releasing factor receptor 1 expressed in CHO-K1 cells after 2 hrs by gamma counting |
Bioorg Med Chem 19: 5432-45 (2011)
Article DOI: 10.1016/j.bmc.2011.07.055
BindingDB Entry DOI: 10.7270/Q2Z038JX |
More data for this
Ligand-Target Pair | |
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