Compile Data Set for Download or QSAR

Found 33 hits Enz. Inhib. hit(s) with all data for entry = 50012209   

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))	BDBM50116112 (CHEMBL67484 | [1,5-Dimethyl-3-(2,4,6-trimethyl-phe...) Show SMILES CCCN(CCC)c1nc(C)nc2c(nn(C)c12)-c1c(C)cc(C)cc1C |(-6.92,3.47,;-5.59,2.68,;-5.62,1.14,;-4.31,.34,;-2.96,1.09,;-2.93,2.63,;-1.58,3.36,;-4.33,-1.2,;-5.69,-1.94,;-5.73,-3.48,;-7.07,-4.23,;-4.4,-4.28,;-3.05,-3.53,;-1.59,-4.04,;-.65,-2.81,;-1.54,-1.54,;-1.04,-.08,;-3.03,-1.99,;-1.14,-5.51,;.36,-5.84,;1.4,-4.71,;.82,-7.31,;-.25,-8.45,;.22,-9.92,;-1.74,-8.1,;-2.19,-6.63,;-3.69,-6.28,)| Show InChI InChI=1S/C22H31N5/c1-8-10-27(11-9-2)22-21-20(23-17(6)24-22)19(25-26(21)7)18-15(4)12-14(3)13-16(18)5/h12-13H,8-11H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116095 (CHEMBL293228 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(.02,4.59,;-1.31,3.8,;-1.3,2.26,;-2.64,1.49,;-3.97,2.26,;-3.98,3.8,;-5.31,4.57,;-2.63,-.05,;-3.96,-.82,;-3.96,-2.36,;-5.3,-3.13,;-2.63,-3.13,;-1.3,-2.36,;.17,-2.85,;.66,-4.32,;-.37,-5.44,;.1,-6.91,;1.61,-7.24,;2.08,-8.7,;2.64,-6.07,;2.15,-4.63,;3.18,-3.48,;1.1,-1.59,;2.64,-1.59,;.17,-.33,;-1.3,-.82,)| Show InChI InChI=1S/C19H23Cl2N5/c1-5-9-26(10-6-2)19-17-16(22-12(3)23-19)18(25(4)24-17)14-8-7-13(20)11-15(14)21/h7-8,11H,5-6,9-10H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116123 (Butyl-[3-(2,4-dichloro-phenyl)-2,5-dimethyl-2H-pyr...) Show SMILES CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(3.45,-.61,;2.12,.16,;.78,-.61,;-.55,.16,;-1.88,-.61,;-3.2,.14,;-4.54,-.63,;-1.88,-2.15,;-3.2,-2.93,;-3.2,-4.47,;-4.53,-5.24,;-1.88,-5.24,;-.54,-4.47,;.93,-4.94,;1.4,-6.41,;.38,-7.54,;.85,-9.01,;2.36,-9.32,;2.82,-10.79,;3.38,-8.16,;2.91,-6.71,;3.92,-5.57,;1.85,-3.69,;3.38,-3.69,;.93,-2.44,;-.54,-2.92,)| Show InChI InChI=1S/C19H23Cl2N5/c1-5-7-10-26(6-2)19-17-16(22-12(3)23-19)18(25(4)24-17)14-9-8-13(20)11-15(14)21/h8-9,11H,5-7,10H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50058163 (Butyl-[2,5-dimethyl-7-(2,4,6-trimethyl-phenyl)-7H-...) Show SMILES CCCCN(CC)c1nc(C)nc2n(cc(C)c12)-c1c(C)cc(C)cc1C |(-10.62,2.69,;-9.29,3.46,;-7.95,2.7,;-6.62,3.48,;-5.28,2.71,;-3.95,3.49,;-3.96,5.03,;-5.27,1.17,;-6.6,.4,;-6.6,-1.14,;-7.94,-1.91,;-5.27,-1.91,;-3.92,-1.14,;-2.44,-1.61,;-1.54,-.35,;-2.46,.9,;-1.99,2.37,;-3.93,.41,;-1.96,-3.07,;-2.99,-4.22,;-4.49,-3.91,;-2.5,-5.68,;-.99,-5.99,;-.51,-7.46,;.03,-4.83,;-.46,-3.38,;.56,-2.22,)| Show InChI InChI=1S/C23H32N4/c1-8-10-11-26(9-2)22-20-18(6)14-27(23(20)25-19(7)24-22)21-16(4)12-15(3)13-17(21)5/h12-14H,8-11H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116093 (CHEMBL304335 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES CCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(2.41,-.08,;1.07,-.85,;-.26,-.08,;-1.6,-.85,;-2.93,-.09,;-4.25,-.86,;-1.58,-2.38,;-2.91,-3.17,;-2.91,-4.7,;-4.25,-5.47,;-1.58,-5.47,;-.25,-4.7,;1.22,-5.18,;1.7,-6.64,;.66,-7.78,;1.14,-9.24,;2.64,-9.55,;3.12,-11.02,;3.66,-8.39,;3.2,-6.94,;4.2,-5.8,;2.13,-3.92,;3.66,-3.92,;1.22,-2.68,;-.25,-3.15,)| Show InChI InChI=1S/C18H21Cl2N5/c1-5-9-25(6-2)18-16-15(21-11(3)22-18)17(24(4)23-16)13-8-7-12(19)10-14(13)20/h7-8,10H,5-6,9H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116092 (CHEMBL66054 | [2-Ethyl-5-methyl-3-(2,4,6-trimethyl...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CC)nc12 |(.47,3.41,;-.88,2.68,;-.91,1.14,;-2.26,.39,;-3.59,1.18,;-3.56,2.72,;-4.87,3.52,;-2.29,-1.15,;-3.64,-1.9,;-3.68,-3.44,;-5.03,-4.18,;-2.36,-4.23,;-1,-3.48,;.45,-4,;.91,-5.47,;-.14,-6.59,;-1.65,-6.24,;.3,-8.06,;1.8,-8.41,;2.26,-9.88,;2.85,-7.26,;2.4,-5.79,;3.44,-4.67,;1.38,-2.76,;2.92,-2.78,;3.72,-1.47,;.5,-1.49,;-.97,-1.94,)| Show InChI InChI=1S/C23H33N5/c1-8-11-27(12-9-2)23-21-20(24-18(7)25-23)22(28(10-3)26-21)19-16(5)13-15(4)14-17(19)6/h13-14H,8-12H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116104 (CHEMBL66275 | [2,5-Dimethyl-3-(2,4,6-trimethyl-phe...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(C)nc12 |(-4.13,3.59,;-2.82,2.79,;-2.84,1.25,;-1.53,.44,;-.18,1.19,;-.14,2.73,;1.2,3.47,;-1.56,-1.1,;-2.91,-1.83,;-2.94,-3.37,;-4.28,-4.11,;-1.63,-4.18,;-.27,-3.43,;1.2,-3.93,;1.64,-5.4,;3.13,-5.74,;4.18,-4.6,;3.6,-7.21,;2.54,-8.34,;2.99,-9.81,;1.03,-7.99,;.59,-6.52,;-.9,-6.17,;2.13,-2.69,;3.67,-2.73,;1.24,-1.43,;-.23,-1.89,)| Show InChI InChI=1S/C22H31N5/c1-8-10-27(11-9-2)22-20-19(23-17(6)24-22)21(26(7)25-20)18-15(4)12-14(3)13-16(18)5/h12-13H,8-11H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116118 (CHEMBL304272 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-7.47,-.08,;-6.12,-.85,;-4.79,-1.61,;-3.46,-.84,;-2.14,-1.59,;-.79,-.82,;.54,-1.59,;1.87,-.82,;3.19,-.05,;-2.12,-3.13,;-3.45,-3.91,;-3.45,-5.45,;-4.79,-6.22,;-2.12,-6.22,;-.78,-5.45,;.68,-5.92,;1.16,-7.39,;.12,-8.53,;.61,-9.99,;2.1,-10.3,;2.59,-11.77,;3.13,-9.16,;2.66,-7.7,;3.68,-6.55,;1.59,-4.67,;3.13,-4.67,;.68,-3.42,;-.78,-3.9,)| Show InChI InChI=1S/C19H23Cl2N5O2/c1-12-22-16-17(19(23-12)26(7-9-27-3)8-10-28-4)24-25(2)18(16)14-6-5-13(20)11-15(14)21/h5-6,11H,7-10H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116109 (CHEMBL302742 | [3-(4-Chloro-2-methyl-phenyl)-2,5-d...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3C)n(C)nc12 |(1.59,4.49,;.26,3.72,;.28,2.18,;-1.06,1.41,;-2.39,2.17,;-2.39,3.7,;-3.73,4.47,;-1.05,-.12,;-2.38,-.91,;-2.38,-2.45,;-3.72,-3.21,;-1.05,-3.21,;.29,-2.45,;1.76,-2.92,;2.24,-4.39,;1.2,-5.52,;1.68,-6.99,;3.18,-7.3,;3.66,-8.77,;4.2,-6.15,;3.74,-4.69,;4.75,-3.55,;2.66,-1.66,;4.2,-1.66,;1.76,-.4,;.29,-.89,)| Show InChI InChI=1S/C20H26ClN5/c1-6-10-26(11-7-2)20-18-17(22-14(4)23-20)19(25(5)24-18)16-9-8-15(21)12-13(16)3/h8-9,12H,6-7,10-11H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116105 (3-(6-(dimethylamino)-4-methylpyridin-3-yl)-2,5-dim...) Show SMILES CCCN(CCC)c1cc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(-1.91,-13.39,;-3.24,-14.16,;-4.58,-13.4,;-5.91,-14.18,;-7.24,-13.41,;-8.57,-14.19,;-9.91,-13.42,;-5.9,-15.72,;-7.22,-16.49,;-7.23,-18.03,;-8.56,-18.8,;-5.9,-18.8,;-4.55,-18.03,;-3.07,-18.5,;-2.16,-17.24,;-.62,-17.23,;-3.09,-15.99,;-4.56,-16.48,;-2.58,-19.96,;-3.61,-21.11,;-3.13,-22.57,;-1.62,-22.88,;-.59,-21.72,;-1.08,-20.27,;-.06,-19.11,;-1.13,-24.34,;.38,-24.65,;-2.15,-25.5,)| Show InChI InChI=1S/C22H32N6/c1-8-10-27(11-9-2)20-13-16(4)24-22-21(17(5)25-28(20)22)18-14-23-19(26(6)7)12-15(18)3/h12-14H,8-11H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116103 (CHEMBL293469 | [3-(2,4-Dimethoxy-phenyl)-2,5-dimet...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)cc3OC)n(C)nc12 |(2.6,4.49,;1.27,3.72,;1.27,2.18,;-.06,1.41,;-1.39,2.17,;-1.4,3.71,;-2.74,4.48,;-.06,-.12,;-1.39,-.91,;-1.39,-2.45,;-2.72,-3.22,;-.06,-3.22,;1.28,-2.45,;2.75,-2.92,;3.23,-4.39,;2.2,-5.53,;2.67,-7,;4.18,-7.31,;4.65,-8.77,;6.16,-9.08,;5.21,-6.16,;4.73,-4.7,;5.75,-3.55,;5.27,-2.1,;3.67,-1.66,;5.21,-1.66,;2.75,-.4,;1.28,-.89,)| Show InChI InChI=1S/C21H29N5O2/c1-7-11-26(12-8-2)21-19-18(22-14(3)23-21)20(25(4)24-19)16-10-9-15(27-5)13-17(16)28-6/h9-10,13H,7-8,11-12H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116099 (CHEMBL68076 | [5-Methyl-2-propyl-3-(2,4,6-trimethy...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CCC)nc12 |(.23,3.24,;-1.11,2.5,;-1.14,.96,;-2.5,.21,;-3.82,1.02,;-3.78,2.56,;-5.1,3.35,;-2.52,-1.33,;-3.87,-2.06,;-3.91,-3.6,;-5.26,-4.35,;-2.59,-4.41,;-1.24,-3.66,;.22,-4.16,;.68,-5.63,;-.37,-6.75,;-1.88,-6.4,;.07,-8.22,;1.57,-8.57,;2.03,-10.04,;2.62,-7.44,;2.17,-5.97,;3.2,-4.84,;1.15,-2.92,;2.69,-2.96,;3.48,-1.64,;5.02,-1.66,;.26,-1.66,;-1.21,-2.12,)| Show InChI InChI=1S/C24H35N5/c1-8-11-28(12-9-2)24-22-21(25-19(7)26-24)23(29(27-22)13-10-3)20-17(5)14-16(4)15-18(20)6/h14-15H,8-13H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116101 (CHEMBL304059 | [1-Ethyl-5-methyl-3-(2,4,6-trimethy...) Show SMILES CCCN(CCC)c1nc(C)nc2c(nn(CC)c12)-c1c(C)cc(C)cc1C |(-1.18,4.5,;-2.52,3.77,;-2.56,2.23,;-3.91,1.49,;-5.22,2.28,;-5.19,3.82,;-6.51,4.61,;-3.93,-.05,;-5.29,-.8,;-5.32,-2.34,;-6.66,-3.09,;-4,-3.13,;-2.65,-2.39,;-1.18,-2.9,;-.25,-1.66,;-1.14,-.4,;-.65,1.07,;.87,1.35,;-2.61,-.85,;-.74,-4.37,;.75,-4.7,;1.8,-3.57,;1.22,-6.17,;.16,-7.31,;.61,-8.78,;-1.35,-6.96,;-1.79,-5.49,;-3.28,-5.14,)| Show InChI InChI=1S/C23H33N5/c1-8-11-27(12-9-2)23-22-21(24-18(7)25-23)20(26-28(22)10-3)19-16(5)13-15(4)14-17(19)6/h13-14H,8-12H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116097 (CHEMBL66719 | [5-Methyl-3-(2,4,6-trimethyl-phenyl)...) Show SMILES CCCN(CCC)c1nc(C)nc2c(n[nH]c12)-c1c(C)cc(C)cc1C |(-1.63,3.13,;-2.98,2.39,;-3.01,.86,;-4.36,.11,;-5.68,.9,;-5.65,2.44,;-6.97,3.23,;-4.39,-1.43,;-5.74,-2.18,;-5.78,-3.72,;-7.13,-4.46,;-4.46,-4.51,;-3.1,-3.76,;-1.65,-4.28,;-.72,-3.04,;-1.6,-1.77,;-3.07,-2.22,;-1.19,-5.75,;-2.24,-6.87,;-3.75,-6.52,;-1.8,-8.34,;-.3,-8.69,;.16,-10.16,;.75,-7.54,;.3,-6.07,;1.34,-4.95,)| Show InChI InChI=1S/C21H29N5/c1-7-9-26(10-8-2)21-20-19(22-16(6)23-21)18(24-25-20)17-14(4)11-13(3)12-15(17)5/h11-12H,7-10H2,1-6H3,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116094 (CHEMBL66492 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-2.82,.14,;-4.15,-.64,;-4.14,-2.17,;-5.48,-2.94,;-5.47,-4.48,;-2.81,-2.94,;-2.81,-4.47,;-4.14,-5.24,;-4.14,-6.79,;-5.47,-7.56,;-2.81,-7.56,;-1.47,-6.79,;,-7.27,;.47,-8.72,;-.55,-9.86,;-.09,-11.33,;1.43,-11.65,;1.9,-13.1,;2.45,-10.49,;1.98,-9.04,;2.99,-7.88,;.92,-6.01,;2.45,-6.01,;,-4.76,;-1.47,-5.24,)| Show InChI InChI=1S/C18H21Cl2N5/c1-5-12(6-2)23-18-16-15(21-10(3)22-18)17(25(4)24-16)13-8-7-11(19)9-14(13)20/h7-9,12H,5-6H2,1-4H3,(H,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116121 (CHEMBL69968 | Cyclopentyl-[3-(2,4-dichloro-phenyl)...) Show SMILES Cc1nc(NC2CCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 |(-4.96,-7.33,;-3.63,-6.56,;-3.63,-5.01,;-2.3,-4.24,;-2.3,-2.7,;-3.63,-1.94,;-5.03,-2.56,;-6.06,-1.42,;-5.31,-.09,;-3.79,-.4,;-.96,-5.01,;.51,-4.53,;1.43,-5.78,;2.97,-5.78,;.51,-7.04,;.99,-8.49,;-.04,-9.63,;.43,-11.1,;1.94,-11.42,;2.41,-12.87,;2.97,-10.26,;2.49,-8.81,;3.5,-7.65,;-.96,-6.56,;-2.3,-7.33,)| Show InChI InChI=1S/C18H19Cl2N5/c1-10-21-15-16(18(22-10)23-12-5-3-4-6-12)24-25(2)17(15)13-8-7-11(19)9-14(13)20/h7-9,12H,3-6H2,1-2H3,(H,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116106 (CHEMBL66831 | [3-(2,6-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3c(Cl)cccc3Cl)n(C)nc12 |(.24,5.09,;-1.09,4.31,;-1.07,2.77,;-2.42,2,;-3.75,2.77,;-3.75,4.31,;-5.09,5.08,;-2.4,.46,;-3.73,-.31,;-3.73,-1.85,;-5.08,-2.62,;-2.4,-2.62,;-1.07,-1.85,;.4,-2.34,;.89,-3.8,;2.39,-4.11,;3.41,-2.96,;2.85,-5.56,;1.83,-6.73,;.33,-6.4,;-.16,-4.93,;-1.66,-4.62,;1.31,-1.08,;2.85,-1.08,;.4,.18,;-1.07,-.31,)| Show InChI InChI=1S/C19H23Cl2N5/c1-5-10-26(11-6-2)19-17-16(22-12(3)23-19)18(25(4)24-17)15-13(20)8-7-9-14(15)21/h7-9H,5-6,10-11H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116120 (CHEMBL303272 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES CCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-5.19,4.82,;-3.86,4.05,;-3.86,2.51,;-2.53,1.76,;-2.51,.22,;-3.84,-.56,;-3.84,-2.1,;-5.18,-2.86,;-2.51,-2.86,;-1.18,-2.1,;.29,-2.57,;.77,-4.03,;-.27,-5.17,;.21,-6.63,;1.71,-6.94,;2.19,-8.41,;2.73,-5.8,;2.27,-4.34,;3.28,-3.2,;1.2,-1.31,;2.73,-1.31,;.29,-.05,;-1.18,-.54,)| Show InChI InChI=1S/C16H17Cl2N5/c1-4-7-19-16-14-13(20-9(2)21-16)15(23(3)22-14)11-6-5-10(17)8-12(11)18/h5-6,8H,4,7H2,1-3H3,(H,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116107 (Butyl-[3-(2,4-dichloro-phenyl)-2,5-dimethyl-2H-pyr...) Show SMILES CCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-3.92,4.22,;-3.92,2.68,;-2.58,1.91,;-2.58,.37,;-1.25,-.4,;-1.24,-1.94,;-2.57,-2.71,;-2.57,-4.25,;-3.91,-5.02,;-1.24,-5.02,;.1,-4.25,;1.57,-4.74,;2.05,-6.21,;1.01,-7.33,;1.49,-8.8,;2.99,-9.13,;3.48,-10.59,;4.02,-7.96,;3.55,-6.52,;4.56,-5.37,;2.48,-3.48,;4.02,-3.48,;1.57,-2.22,;.1,-2.71,)| Show InChI InChI=1S/C17H19Cl2N5/c1-4-5-8-20-17-15-14(21-10(2)22-17)16(24(3)23-15)12-7-6-11(18)9-13(12)19/h6-7,9H,4-5,8H2,1-3H3,(H,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116113 (CHEMBL68697 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCCCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(5.23,-.47,;3.9,.28,;2.57,-.49,;1.24,.27,;-.09,-.5,;-1.42,.27,;-2.77,-.5,;-4.1,.26,;-5.42,-.51,;-2.75,-2.04,;-4.08,-2.82,;-4.08,-4.36,;-5.42,-5.13,;-2.75,-5.13,;-1.41,-4.36,;.05,-4.83,;.54,-6.3,;-.51,-7.44,;-.02,-8.91,;1.48,-9.22,;1.96,-10.69,;2.5,-8.05,;2.04,-6.61,;3.05,-5.46,;.96,-3.57,;2.5,-3.57,;.05,-2.33,;-1.41,-2.81,)| Show InChI InChI=1S/C21H27Cl2N5/c1-5-7-8-9-12-28(6-2)21-19-18(24-14(3)25-21)20(27(4)26-19)16-11-10-15(22)13-17(16)23/h10-11,13H,5-9,12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116096 (CHEMBL417039 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES CCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-5.54,4.79,;-4.21,4.03,;-4.21,2.49,;-2.87,1.72,;-2.86,.19,;-1.53,-.57,;-1.53,-2.1,;-2.86,-2.89,;-2.86,-4.43,;-4.19,-5.2,;-1.53,-5.2,;-.19,-4.43,;1.28,-4.9,;1.76,-6.37,;.73,-7.5,;1.2,-8.97,;2.71,-9.28,;3.18,-10.75,;3.74,-8.13,;3.26,-6.67,;4.27,-5.53,;2.2,-3.64,;3.74,-3.64,;1.28,-2.4,;-.19,-2.87,)| Show InChI InChI=1S/C18H21Cl2N5/c1-4-5-6-9-21-18-16-15(22-11(2)23-18)17(25(3)24-16)13-8-7-12(19)10-14(13)20/h7-8,10H,4-6,9H2,1-3H3,(H,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	38	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116117 (CHEMBL67483 | [5-Methyl-1-propyl-3-(2,4,6-trimethy...) Show SMILES CCCN(CCC)c1nc(C)nc2c(nn(CCC)c12)-c1c(C)cc(C)cc1C |(-1.18,4.5,;-2.52,3.77,;-2.56,2.23,;-3.91,1.48,;-5.22,2.28,;-5.19,3.82,;-6.51,4.61,;-3.93,-.05,;-5.29,-.8,;-5.32,-2.34,;-6.66,-3.09,;-4,-3.13,;-2.65,-2.39,;-1.18,-2.9,;-.25,-1.66,;-1.14,-.4,;-.65,1.07,;.87,1.35,;1.38,2.81,;-2.61,-.85,;-.74,-4.37,;.75,-4.7,;1.8,-3.57,;1.22,-6.17,;.16,-7.31,;.61,-8.78,;-1.35,-6.96,;-1.79,-5.49,;-3.28,-5.14,)| Show InChI InChI=1S/C24H35N5/c1-8-11-28(12-9-2)24-23-22(25-19(7)26-24)21(27-29(23)13-10-3)20-17(5)14-16(4)15-18(20)6/h14-15H,8-13H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116108 (CHEMBL68303 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-5.45,5.9,;-5.44,4.36,;-4.1,3.59,;-4.1,2.05,;-2.77,1.28,;-2.75,-.26,;-1.42,-1.01,;-1.42,-2.55,;-2.75,-3.34,;-2.75,-4.88,;-4.08,-5.65,;-1.42,-5.65,;-.09,-4.88,;1.38,-5.35,;1.87,-6.82,;.84,-7.94,;1.31,-9.43,;2.82,-9.74,;3.3,-11.21,;3.85,-8.59,;3.37,-7.12,;4.39,-5.98,;2.31,-4.09,;3.85,-4.09,;1.38,-2.85,;-.09,-3.32,)| Show InChI InChI=1S/C19H23Cl2N5/c1-4-5-6-7-10-22-19-17-16(23-12(2)24-19)18(26(3)25-17)14-9-8-13(20)11-15(14)21/h8-9,11H,4-7,10H2,1-3H3,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116098 (CHEMBL67646 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCCN(CCN1CCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-3.49,3.32,;-2.17,2.56,;-.84,3.32,;.49,2.58,;1.82,3.35,;3.15,2.58,;4.5,3.35,;4.67,4.89,;6.18,5.21,;6.95,3.86,;5.9,2.72,;.49,1.04,;-.84,.27,;-.84,-1.29,;-2.17,-2.06,;.49,-2.06,;1.84,-1.29,;3.31,-1.76,;3.77,-3.22,;2.75,-4.36,;3.22,-5.83,;4.73,-6.14,;5.2,-7.6,;5.75,-4.99,;5.29,-3.53,;6.29,-2.38,;4.2,-.5,;5.75,-.5,;3.31,.74,;1.84,.27,)| Show InChI InChI=1S/C22H28Cl2N6/c1-4-9-30(13-12-29-10-5-6-11-29)22-20-19(25-15(2)26-22)21(28(3)27-20)17-8-7-16(23)14-18(17)24/h7-8,14H,4-6,9-13H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	115	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116122 (CHEMBL303639 | N-[3-(2,4-Dichloro-phenyl)-2,5-dime...) Show SMILES CCCN(CCN(C)C)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-5.89,-.5,;-4.56,-1.26,;-3.22,-.49,;-1.89,-1.24,;-.55,-.47,;.78,-1.24,;2.11,-.47,;3.44,-1.24,;2.11,1.07,;-1.88,-2.78,;-3.21,-3.57,;-3.21,-5.11,;-4.55,-5.88,;-1.88,-5.88,;-.55,-5.11,;.92,-5.58,;1.41,-7.05,;.37,-8.17,;.85,-9.66,;2.36,-9.97,;2.83,-11.44,;3.38,-8.82,;2.9,-7.36,;3.93,-6.21,;1.84,-4.32,;3.38,-4.32,;.92,-3.08,;-.55,-3.55,)| Show InChI InChI=1S/C20H26Cl2N6/c1-6-9-28(11-10-26(3)4)20-18-17(23-13(2)24-20)19(27(5)25-18)15-8-7-14(21)12-16(15)22/h7-8,12H,6,9-11H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	145	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116115 (CHEMBL66631 | Cyclohexyl-[3-(2,4-dichloro-phenyl)-...) Show SMILES Cc1nc(NC2CCCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 |(-4.56,-7.02,;-3.23,-6.25,;-3.23,-4.71,;-1.9,-3.94,;-1.9,-2.4,;-3.24,-1.63,;-4.57,-2.41,;-5.91,-1.64,;-5.91,-.09,;-4.57,.67,;-3.24,-.09,;-.56,-4.71,;.91,-4.22,;1.82,-5.47,;3.36,-5.47,;.91,-6.73,;1.38,-8.19,;.36,-9.33,;.82,-10.79,;2.34,-11.11,;2.8,-12.56,;3.36,-9.96,;2.89,-8.5,;3.9,-7.35,;-.56,-6.25,;-1.9,-7.02,)| Show InChI InChI=1S/C19H21Cl2N5/c1-11-22-16-17(19(23-11)24-13-6-4-3-5-7-13)25-26(2)18(16)14-9-8-12(20)10-15(14)21/h8-10,13H,3-7H2,1-2H3,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	174	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116100 (CHEMBL66052 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-3.84,4.05,;-3.84,2.52,;-2.51,1.76,;-2.51,.23,;-3.84,-.56,;-3.84,-2.1,;-5.16,-2.87,;-2.51,-2.87,;-1.16,-2.1,;.3,-2.57,;.78,-4.04,;-.25,-5.17,;.22,-6.64,;1.73,-6.95,;2.2,-8.42,;2.76,-5.8,;2.28,-4.34,;3.29,-3.2,;1.22,-1.31,;2.76,-1.31,;.3,-.05,;-1.16,-.54,)| Show InChI InChI=1S/C15H15Cl2N5/c1-4-18-15-13-12(19-8(2)20-15)14(22(3)21-13)10-6-5-9(16)7-11(10)17/h5-7H,4H2,1-3H3,(H,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	192	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116110 (CHEMBL66671 | [3-(2,4-Dichloro-phenyl)-2,5-dimethy...) Show SMILES CCCN(CCN1CCCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(2.66,-1.91,;3.97,-2.68,;5.32,-1.91,;6.65,-2.67,;7.98,-1.89,;9.31,-2.66,;10.65,-1.89,;10.65,-.33,;12,.44,;13.34,-.36,;13.32,-1.9,;11.99,-2.67,;6.65,-4.2,;5.32,-4.97,;5.32,-6.53,;3.99,-7.3,;6.65,-7.3,;8,-6.53,;9.46,-7,;9.94,-8.46,;8.91,-9.6,;9.38,-11.07,;10.89,-11.38,;11.36,-12.84,;11.92,-10.23,;11.45,-8.77,;12.46,-7.62,;10.38,-5.74,;11.92,-5.74,;9.46,-4.5,;8,-4.97,)| Show InChI InChI=1S/C23H30Cl2N6/c1-4-10-31(14-13-30-11-6-5-7-12-30)23-21-20(26-16(2)27-23)22(29(3)28-21)18-9-8-17(24)15-19(18)25/h8-9,15H,4-7,10-14H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	561	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116119 (CHEMBL67360 | [3-(2-Chloro-phenyl)-2,5-dimethyl-2H...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccccc3Cl)n(C)nc12 |(1.06,4.4,;-.27,3.63,;-.27,2.09,;-1.6,1.32,;-2.93,2.07,;-2.94,3.61,;-4.28,4.38,;-1.6,-.22,;-2.93,-1,;-2.93,-2.54,;-4.26,-3.31,;-1.6,-3.31,;-.26,-2.54,;1.21,-3.01,;1.69,-4.48,;.66,-5.61,;1.13,-7.08,;2.64,-7.39,;3.67,-6.24,;3.19,-4.78,;4.2,-3.64,;2.13,-1.76,;3.67,-1.76,;1.21,-.51,;-.26,-.99,)| Show InChI InChI=1S/C19H24ClN5/c1-5-11-25(12-6-2)19-17-16(21-13(3)22-19)18(24(4)23-17)14-9-7-8-10-15(14)20/h7-10H,5-6,11-12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	765	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116116 ((2,5-Dimethyl-3-phenyl-2H-pyrazolo[4,3-d]pyrimidin...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccccc3)n(C)nc12 Show InChI InChI=1S/C19H25N5/c1-5-12-24(13-6-2)19-17-16(20-14(3)21-19)18(23(4)22-17)15-10-8-7-9-11-15/h7-11H,5-6,12-13H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116114 (CHEMBL306866 | [3-(3-Chloro-phenyl)-2,5-dimethyl-2...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3cccc(Cl)c3)n(C)nc12 Show InChI InChI=1S/C19H24ClN5/c1-5-10-25(11-6-2)19-17-16(21-13(3)22-19)18(24(4)23-17)14-8-7-9-15(20)12-14/h7-9,12H,5-6,10-11H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116102 (CHEMBL302037 | [3-(2,4-Dichloro-phenyl)-2,5-dimeth...) Show SMILES CNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 |(-3.32,2.46,;-1.98,1.7,;-1.97,.16,;-3.3,-.61,;-3.3,-2.15,;-4.64,-2.92,;-1.97,-2.92,;-.64,-2.15,;.82,-2.63,;1.31,-4.09,;.28,-5.23,;.75,-6.7,;2.26,-7.01,;2.73,-8.47,;3.29,-5.86,;2.8,-4.4,;3.83,-3.25,;1.75,-1.37,;3.29,-1.37,;.82,-.12,;-.64,-.61,)| Show InChI InChI=1S/C14H13Cl2N5/c1-7-18-11-12(14(17-2)19-7)20-21(3)13(11)9-5-4-8(15)6-10(9)16/h4-6H,1-3H3,(H,17,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50116111 (CHEMBL66010 | [3-(4-Chloro-phenyl)-2,5-dimethyl-2H...) Show SMILES CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3)n(C)nc12 Show InChI InChI=1S/C19H24ClN5/c1-5-11-25(12-6-2)19-17-16(21-13(3)22-19)18(24(4)23-17)14-7-9-15(20)10-8-14/h7-10H,5-6,11-12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 endogenously expressed in IMR-32 human neuroblastoma cells				Bioorg Med Chem Lett 12: 2133-6 (2002) BindingDB Entry DOI: 10.7270/Q2SQ8ZPK
					More data for this Ligand-Target Pair