Compile Data Set for Download or QSAR

Found 18 hits Enz. Inhib. hit(s) with all data for entry = 50048540   

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 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218669 (CHEMBL97868) Show SMILES CCN(CC)c1nccn2c(Nc3ccc(Cl)cc3Cl)nc(CC)c12 Show InChI InChI=1S/C18H21Cl2N5/c1-4-14-16-17(24(5-2)6-3)21-9-10-25(16)18(22-14)23-15-8-7-12(19)11-13(15)20/h7-11H,4-6H2,1-3H3,(H,22,23)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	127	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218662 (CHEMBL100943) Show SMILES CCN(CC)c1nccn2c(Nc3c(C)cc(C)cc3C)nc(CC)c12 Show InChI InChI=1S/C21H29N5/c1-7-17-19-20(25(8-2)9-3)22-10-11-26(19)21(23-17)24-18-15(5)12-14(4)13-16(18)6/h10-13H,7-9H2,1-6H3,(H,23,24)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	143	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218754 (CHEMBL101574) Show SMILES CCCN(CCC)c1nccn2c(Nc3c(C)cc(C)cc3C)nc(CC)c12 Show InChI InChI=1S/C23H33N5/c1-7-11-27(12-8-2)22-21-19(9-3)25-23(28(21)13-10-24-22)26-20-17(5)14-16(4)15-18(20)6/h10,13-15H,7-9,11-12H2,1-6H3,(H,25,26)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	173	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218684 (CHEMBL99741) Show SMILES CCCN(CCC)c1nccn2c(Nc3ccc(Cl)cc3Cl)nc(CC)c12 Show InChI InChI=1S/C20H25Cl2N5/c1-4-10-26(11-5-2)19-18-16(6-3)24-20(27(18)12-9-23-19)25-17-8-7-14(21)13-15(17)22/h7-9,12-13H,4-6,10-11H2,1-3H3,(H,24,25)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	223	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218683 (CHEMBL98643) Show SMILES CCCc1nc(N(C)c2ccc(Cl)cc2Cl)n2ccnc(N(CC)CC)c12 Show InChI InChI=1S/C20H25Cl2N5/c1-5-8-16-18-19(26(6-2)7-3)23-11-12-27(18)20(24-16)25(4)17-10-9-14(21)13-15(17)22/h9-13H,5-8H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	324	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218680 (CHEMBL318652) Show SMILES CCN(CC)c1nccn2c(Nc3ccc(Cl)cc3Cl)nc(C)c12 Show InChI InChI=1S/C17H19Cl2N5/c1-4-23(5-2)16-15-11(3)21-17(24(15)9-8-20-16)22-14-7-6-12(18)10-13(14)19/h6-10H,4-5H2,1-3H3,(H,21,22)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	485	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218753 (CHEMBL101093) Show SMILES CCCN(CCC)c1nccn2c(Nc3ccc(Cl)cc3Cl)nc(CCC)c12 Show InChI InChI=1S/C21H27Cl2N5/c1-4-7-18-19-20(27(11-5-2)12-6-3)24-10-13-28(19)21(26-18)25-17-9-8-15(22)14-16(17)23/h8-10,13-14H,4-7,11-12H2,1-3H3,(H,25,26)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	492	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218687 (CHEMBL327285) Show SMILES CCCN(CCC)c1nccn2c(Nc3ccc(Cl)cc3Cl)nc(C)c12 Show InChI InChI=1S/C19H23Cl2N5/c1-4-9-25(10-5-2)18-17-13(3)23-19(26(17)11-8-22-18)24-16-7-6-14(20)12-15(16)21/h6-8,11-12H,4-5,9-10H2,1-3H3,(H,23,24)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	597	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218685 (CHEMBL316839) Show SMILES CCCN(CCC)c1nccn2c(nc(CCC)c12)N(C)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C22H29Cl2N5/c1-5-8-18-20-21(28(12-6-2)13-7-3)25-11-14-29(20)22(26-18)27(4)19-10-9-16(23)15-17(19)24/h9-11,14-15H,5-8,12-13H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	623	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218661 (CHEMBL98693) Show SMILES CCCN(CCC)c1nccn2c(nc(C)c12)N(CC)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H27Cl2N5/c1-5-11-26(12-6-2)20-19-15(4)25-21(28(19)13-10-24-20)27(7-3)18-9-8-16(22)14-17(18)23/h8-10,13-14H,5-7,11-12H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	671	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218681 (CHEMBL98091) Show SMILES CCCc1nc(Nc2ccc(Cl)cc2Cl)n2ccnc(N(CC)CC)c12 Show InChI InChI=1S/C19H23Cl2N5/c1-4-7-16-17-18(25(5-2)6-3)22-10-11-26(17)19(24-16)23-15-9-8-13(20)12-14(15)21/h8-12H,4-7H2,1-3H3,(H,23,24)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	825	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218679 (CHEMBL100168) Show SMILES CCCc1nc(Nc2c(C)cc(C)cc2C)n2ccnc(N(CC)CC)c12 Show InChI InChI=1S/C22H31N5/c1-7-10-18-20-21(26(8-2)9-3)23-11-12-27(20)22(24-18)25-19-16(5)13-15(4)14-17(19)6/h11-14H,7-10H2,1-6H3,(H,24,25)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218759 (CHEMBL99155) Show SMILES CCCN(CCC)c1nccn2c(nc(C)c12)N(C)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C20H25Cl2N5/c1-5-10-26(11-6-2)19-18-14(3)24-20(27(18)12-9-23-19)25(4)17-8-7-15(21)13-16(17)22/h7-9,12-13H,5-6,10-11H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218975 (CHEMBL431229) Show SMILES CCCN(CCC)c1nccn2c(nc(CC)c12)N(CC)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C22H29Cl2N5/c1-5-12-27(13-6-2)21-20-18(7-3)26-22(29(20)14-11-25-21)28(8-4)19-10-9-16(23)15-17(19)24/h9-11,14-15H,5-8,12-13H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.54E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218678 (CHEMBL317436) Show SMILES CCCc1nc(N(CC)c2ccc(Cl)cc2Cl)n2ccnc(N(CC)CC)c12 Show InChI InChI=1S/C21H27Cl2N5/c1-5-9-17-19-20(26(6-2)7-3)24-12-13-28(19)21(25-17)27(8-4)18-11-10-15(22)14-16(18)23/h10-14H,5-9H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.22E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218797 (CHEMBL320384) Show SMILES CCCc1nc(N(CC)c2ccc(Cl)cc2Cl)n2ccnc(N(C)C)c12 Show InChI InChI=1S/C19H23Cl2N5/c1-5-7-15-17-18(24(3)4)22-10-11-26(17)19(23-15)25(6-2)16-9-8-13(20)12-14(16)21/h8-12H,5-7H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218686 (CHEMBL318729) Show SMILES CCN(c1nc(CC)c2c(nccn12)N(C)C)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C18H21Cl2N5/c1-5-14-16-17(23(3)4)21-9-10-25(16)18(22-14)24(6-2)15-8-7-12(19)11-13(15)20/h7-11H,5-6H2,1-4H3	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.88E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1/2 (Rattus norvegicus (rat)-RAT)	BDBM50218660 (CHEMBL99550) Show SMILES CCC(CC)Nc1nccn2c(Nc3ccc(Cl)cc3Cl)nc(C)c12 Show InChI InChI=1S/C18H21Cl2N5/c1-4-13(5-2)23-17-16-11(3)22-18(25(16)9-8-21-17)24-15-7-6-12(19)10-14(15)20/h6-10,13H,4-5H2,1-3H3,(H,21,23)(H,22,24)	PDB MMDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.				Bioorg Med Chem Lett 12: 291-4 (2002) BindingDB Entry DOI: 10.7270/Q22N54H2
					More data for this Ligand-Target Pair