Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with all data for entry = 50007484   

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
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50002692 ((AZT) 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-...) Show SMILES Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7+,8+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063941 (5,6-Dichloro-1-(4-chloro-benzyl)-1H-benzoimidazol-...) Show SMILES Nc1nc2cc(Cl)c(Cl)cc2n1Cc1ccc(Cl)cc1 Show InChI InChI=1S/C14H10Cl3N3/c15-9-3-1-8(2-4-9)7-20-13-6-11(17)10(16)5-12(13)19-14(20)18/h1-6H,7H2,(H2,18,19)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase (RT) assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063977 (5,6-Dichloro-1-(4-trifluoromethyl-benzyl)-1H-benzo...) Show SMILES Nc1nc2cc(Cl)c(Cl)cc2n1Cc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C15H10Cl2F3N3/c16-10-5-12-13(6-11(10)17)23(14(21)22-12)7-8-1-3-9(4-2-8)15(18,19)20/h1-6H,7H2,(H2,21,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063948 (2-Bromo-5,6-dichloro-1-(3-nitro-benzyl)-1H-benzoim...) Show SMILES [O-][N+](=O)c1cccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)c1 Show InChI InChI=1S/C14H8BrCl2N3O2/c15-14-18-12-5-10(16)11(17)6-13(12)19(14)7-8-2-1-3-9(4-8)20(21)22/h1-6H,7H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase (RT) assay in CEM-SS cells.				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063945 (2-Bromo-5,6-dichloro-1-(3-methyl-benzyl)-1H-benzoi...) Show SMILES Cc1cccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)c1 Show InChI InChI=1S/C15H11BrCl2N2/c1-9-3-2-4-10(5-9)8-20-14-7-12(18)11(17)6-13(14)19-15(20)16/h2-7H,8H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063968 (1-(3,5-Bis-trifluoromethyl-benzyl)-2-bromo-5,6-dic...) Show SMILES FC(F)(F)c1cc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc(c1)C(F)(F)F Show InChI InChI=1S/C16H7BrCl2F6N2/c17-14-26-12-4-10(18)11(19)5-13(12)27(14)6-7-1-8(15(20,21)22)3-9(2-7)16(23,24)25/h1-5H,6H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063972 (2,5,6-Trichloro-1-(4-methyl-benzyl)-1H-benzoimidaz...) Show SMILES Cc1ccc(Cn2c(Cl)nc3cc(Cl)c(Cl)cc23)cc1 Show InChI InChI=1S/C15H11Cl3N2/c1-9-2-4-10(5-3-9)8-20-14-7-12(17)11(16)6-13(14)19-15(20)18/h2-7H,8H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063958 (2,5,6-Trichloro-1-(4-nitro-benzyl)-1H-benzoimidazo...) Show SMILES [O-][N+](=O)c1ccc(Cn2c(Cl)nc3cc(Cl)c(Cl)cc23)cc1 Show InChI InChI=1S/C14H8Cl3N3O2/c15-10-5-12-13(6-11(10)16)19(14(17)18-12)7-8-1-3-9(4-2-8)20(21)22/h1-6H,7H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063970 (2-Bromo-5,6-dichloro-1-(3,4-dichloro-benzyl)-1H-be...) Show SMILES Clc1ccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc1Cl Show InChI InChI=1S/C14H7BrCl4N2/c15-14-20-12-4-10(18)11(19)5-13(12)21(14)6-7-1-2-8(16)9(17)3-7/h1-5H,6H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay in CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50063937 (2-Bromo-5,6-dichloro-1-(4-methoxy-benzyl)-1H-benzo...) Show SMILES COc1ccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc1 Show InChI InChI=1S/C15H11BrCl2N2O/c1-21-10-4-2-9(3-5-10)8-20-14-7-12(18)11(17)6-13(14)19-15(20)16/h2-7H,8H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antiviral activity against Human Immunodeficiency Virus by Reverse transcriptase assay CEM-SS cells				J Med Chem 41: 1252-62 (1998) Article DOI: 10.1021/jm970559i BindingDB Entry DOI: 10.7270/Q2P26X8J
					More data for this Ligand-Target Pair