Compile Data Set for Download or QSAR

Found 12 hits Enz. Inhib. hit(s) with all data for entry = 50029217   

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
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282350 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-diiodo-ph...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(I)c(O)c(I)c1 Show InChI InChI=1S/C18H18I2N2O/c1-2-3-8-17-21-15-6-4-5-7-16(15)22(17)11-12-9-13(19)18(23)14(20)10-12/h4-7,9-10,23H,2-3,8,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282352 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-dinitro-p...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(c(O)c(c1)[N+]([O-])=O)[N+]([O-])=O Show InChI InChI=1S/C18H18N4O5/c1-2-3-8-17-19-13-6-4-5-7-14(13)20(17)11-12-9-15(21(24)25)18(23)16(10-12)22(26)27/h4-7,9-10,23H,2-3,8,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282347 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2-methyl-6-ni...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(C)c(O)c(c1)[N+]([O-])=O Show InChI InChI=1S/C19H21N3O3/c1-3-4-9-18-20-15-7-5-6-8-16(15)21(18)12-14-10-13(2)19(23)17(11-14)22(24)25/h5-8,10-11,23H,3-4,9,12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282346 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2-iodo-6-meth...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(C)c(O)c(I)c1 Show InChI InChI=1S/C19H21IN2O/c1-3-4-9-18-21-16-7-5-6-8-17(16)22(18)12-14-10-13(2)19(23)15(20)11-14/h5-8,10-11,23H,3-4,9,12H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282349 (2,6-Dibromo-4-(2-butyl-benzoimidazol-1-ylmethyl)-p...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(Br)c(O)c(Br)c1 Show InChI InChI=1S/C18H18Br2N2O/c1-2-3-8-17-21-15-6-4-5-7-16(15)22(17)11-12-9-13(19)18(23)14(20)10-12/h4-7,9-10,23H,2-3,8,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282348 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-dichloro-...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(Cl)c(O)c(Cl)c1 Show InChI InChI=1S/C18H18Cl2N2O/c1-2-3-8-17-21-15-6-4-5-7-16(15)22(17)11-12-9-13(19)18(23)14(20)10-12/h4-7,9-10,23H,2-3,8,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282353 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-dimethyl-...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(C)c(O)c(C)c1 Show InChI InChI=1S/C20H24N2O/c1-4-5-10-19-21-17-8-6-7-9-18(17)22(19)13-16-11-14(2)20(23)15(3)12-16/h6-9,11-12,23H,4-5,10,13H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282355 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-phenol | CHEM...) Show SMILES CCCCc1nc2ccccc2n1Cc1ccc(O)cc1 Show InChI InChI=1S/C18H20N2O/c1-2-3-8-18-19-16-6-4-5-7-17(16)20(18)13-14-9-11-15(21)12-10-14/h4-7,9-12,21H,2-3,8,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282356 (4-(2-Butyl-benzoimidazol-1-ylmethyl)-2-methyl-phen...) Show SMILES CCCCc1nc2ccccc2n1Cc1ccc(O)c(C)c1 Show InChI InChI=1S/C19H22N2O/c1-3-4-9-19-20-16-7-5-6-8-17(16)21(19)13-15-10-11-18(22)14(2)12-15/h5-8,10-12,22H,3-4,9,13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282354 (3-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-diiodo-ph...) Show SMILES CCCCc1nc2ccccc2n1Cc1ccc(I)c(O)c1I Show InChI InChI=1S/C18H18I2N2O/c1-2-3-8-16-21-14-6-4-5-7-15(14)22(16)11-12-9-10-13(19)18(23)17(12)20/h4-7,9-10,23H,2-3,8,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282357 (4-[2-(2-Butyl-benzoimidazol-1-yl)-ethyl]-2,6-diiod...) Show SMILES CCCCc1nc2ccccc2n1CCc1cc(I)c(O)c(I)c1 Show InChI InChI=1S/C19H20I2N2O/c1-2-3-8-18-22-16-6-4-5-7-17(16)23(18)10-9-13-11-14(20)19(24)15(21)12-13/h4-7,11-12,24H,2-3,8-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	8.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Bos taurus)	BDBM50282351 (2,6-Di-tert-butyl-4-(2-butyl-benzoimidazol-1-ylmet...) Show SMILES CCCCc1nc2ccccc2n1Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C Show InChI InChI=1S/C26H36N2O/c1-8-9-14-23-27-21-12-10-11-13-22(21)28(23)17-18-15-19(25(2,3)4)24(29)20(16-18)26(5,6)7/h10-13,15-16,29H,8-9,14,17H2,1-7H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-[Ile5]-AII binding to bovine adrenal cortex membrane Angiotensin II receptor type 1				Bioorg Med Chem Lett 4: 213-218 (1994) Article DOI: 10.1016/S0960-894X(01)81149-5 BindingDB Entry DOI: 10.7270/Q2K0747B
					More data for this Ligand-Target Pair