Compile Data Set for Download or QSAR

Found 11 hits Enz. Inhib. hit(s) with all data for entry = 50029682   

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
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286807 (1,1a,6,6a-Tetrahydro-cyclopropa[a]indene-3,4-diol ...) Show SMILES Oc1cc2CC3CC3c2cc1O Show InChI InChI=1S/C10H10O2/c11-9-3-6-1-5-2-7(5)8(6)4-10(9)12/h3-5,7,11-12H,1-2H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.09E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286815 (1,1a,6,6a-Tetrahydro-cyclopropa[a]inden-3-ol | CHE...) Show SMILES Oc1ccc2CC3CC3c2c1 Show InChI InChI=1S/C10H10O/c11-8-2-1-6-3-7-4-9(7)10(6)5-8/h1-2,5,7,9,11H,3-4H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286808 (1,1a,7,7a-Tetrahydro-3,5-dioxa-cyclopropa[a]-s-ind...) Show SMILES C1C2Cc3cc4OCOc4cc3C12 Show InChI InChI=1S/C11H10O2/c1-6-2-8(6)9-4-11-10(3-7(1)9)12-5-13-11/h3-4,6,8H,1-2,5H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.60E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286814 (1-Cyclopropylmethyl-4-methoxy-benzene | CHEMBL1766...) Show SMILES COc1ccc(CC2CC2)cc1 Show InChI InChI=1S/C11H14O/c1-12-11-6-4-10(5-7-11)8-9-2-3-9/h4-7,9H,2-3,8H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article	2.40E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286813 (3-Methoxy-1,1a,6,6a-tetrahydro-1-aza-cyclopropa[a]...) Show SMILES COc1ccc2CC3NC3c2c1 Show InChI InChI=1S/C10H11NO/c1-12-7-3-2-6-4-9-10(11-9)8(6)5-7/h2-3,5,9-11H,4H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286811 (3-Methoxy-6,6a-dihydro-1aH-1-oxa-cyclopropa[a]inde...) Show SMILES COc1ccc2CC3OC3c2c1 Show InChI InChI=1S/C10H10O2/c1-11-7-3-2-6-4-9-10(12-9)8(6)5-7/h2-3,5,9-10H,4H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	6.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286809 (7,7a-Dihydro-1aH-1,3,5-trioxa-cyclopropa[a]-s-inda...) Show SMILES C1Oc2cc3CC4OC4c3cc2O1 Show InChI InChI=1S/C10H8O3/c1-5-2-9-10(13-9)6(5)3-8-7(1)11-4-12-8/h1,3,9-10H,2,4H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.01E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286812 (6,6a-Dihydro-1aH-1-oxa-cyclopropa[a]indene | CHEMB...) Show SMILES C1C2OC2c2ccccc12 Show InChI InChI=1S/C9H8O/c1-2-4-7-6(3-1)5-8-9(7)10-8/h1-4,8-9H,5H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article	1.06E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286810 (3-Methoxy-1,1a,6,6a-tetrahydro-cyclopropa[a]indene...) Show SMILES COc1ccc2CC3CC3c2c1 Show InChI InChI=1S/C11H12O/c1-12-9-3-2-7-4-8-5-10(8)11(7)6-9/h2-3,6,8,10H,4-5H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.12E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50286806 (1,1a,6,6a-Tetrahydro-cyclopropa[a]indene | CHEMBL1...) Show SMILES C1C2Cc3ccccc3C12 Show InChI InChI=1S/C10H10/c1-2-4-9-7(3-1)5-8-6-10(8)9/h1-4,8,10H,5-6H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article	3.03E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50023371 (4-Cyclopropylmethyl-phenol | CHEMBL162030) Show SMILES Oc1ccc(CC2CC2)cc1 Show InChI InChI=1S/C10H12O/c11-10-5-3-9(4-6-10)7-8-1-2-8/h3-6,8,11H,1-2,7H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	1.20E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constant for inhibition (KI) of Dopamine beta-Hydroxylase(DBH) from bovine adrenal medulla				Bioorg Med Chem Lett 5: 941-944 (1995) Article DOI: 10.1016/0960-894X(95)00147-L BindingDB Entry DOI: 10.7270/Q2542NKS
					More data for this Ligand-Target Pair