Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Dehaloperoxidase B'   

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
Dehaloperoxidase B (Amphitrite ornata)	BDBM7882 (1H-imidazole | CHEMBL540 | Imidazole (Im) | US9138...) Show SMILES c1c[nH]cn1 Show InChI InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	n/a	5.20E+4	n/a	n/a	n/a	7.0	n/a
North Carolina State University					Assay Description Samples for solution resonance Raman spectroscopic studies were prepared withfinal concentrations of 75 μM WT DHP B and 3.75 mM azole in 100 mM ...				Biochemistry 56: 2294-2303 (2017) Article DOI: 10.1021/acs.biochem.7b00041 BindingDB Entry DOI: 10.7270/Q2XS5T7W
					More data for this Ligand-Target Pair
Dehaloperoxidase B (Amphitrite ornata)	BDBM7939 (1H-1,3-benzodiazole | Benzimidazole | Benzimidazol...) Show SMILES c1nc2ccccc2[nH]1 Show InChI InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase MCE KEGG MMDB PC cid PC sid PDB UniChem Patents	PDB Article PubMed	n/a	n/a	n/a	1.10E+5	n/a	n/a	n/a	7.0	n/a
North Carolina State University					Assay Description Samples for solution resonance Raman spectroscopic studies were prepared withfinal concentrations of 75 μM WT DHP B and 3.75 mM azole in 100 mM ...				Biochemistry 56: 2294-2303 (2017) Article DOI: 10.1021/acs.biochem.7b00041 BindingDB Entry DOI: 10.7270/Q2XS5T7W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dehaloperoxidase B (Amphitrite ornata)	BDBM36293 (1,2,3-benzotriazole | Benzotriazole (Bta)) Show SMILES c1ccc2nnnc2c1 Show InChI InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase MMDB PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	8.20E+4	n/a	n/a	n/a	7.0	n/a
North Carolina State University					Assay Description Samples for solution resonance Raman spectroscopic studies were prepared withfinal concentrations of 75 μM WT DHP B and 3.75 mM azole in 100 mM ...				Biochemistry 56: 2294-2303 (2017) Article DOI: 10.1021/acs.biochem.7b00041 BindingDB Entry DOI: 10.7270/Q2XS5T7W
					More data for this Ligand-Target Pair