Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with all data for entry = 50005338   

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 PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
BioChem Therapeutic Inc. Curated by ChEMBL					Assay Description Ability to inhibit the HIV-1 reverse transcriptase in cord blood mononuclear cells.				J Med Chem 38: 1-4 (1995) BindingDB Entry DOI: 10.7270/Q2VD6XHP
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50035784 (4-Amino-5-fluoro-1-((3R,5R)-5-hydroxymethyl-tetrah...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CS[C@@H](CO)C1 Show InChI InChI=1S/C9H12FN3O2S/c10-7-2-13(9(15)12-8(7)11)5-1-6(3-14)16-4-5/h2,5-6,14H,1,3-4H2,(H2,11,12,15)/t5-,6-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
BioChem Therapeutic Inc. Curated by ChEMBL					Assay Description Ability to inhibit the HIV-1 reverse transcriptase in cord blood mononuclear cells.				J Med Chem 38: 1-4 (1995) BindingDB Entry DOI: 10.7270/Q2VD6XHP
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50035787 (4-Amino-5-fluoro-1-((2S,5R)-5-hydroxymethyl-tetrah...) Show SMILES Nc1nc(=O)n(cc1F)[C@@H]1CC[C@H](CO)S1 Show InChI InChI=1S/C9H12FN3O2S/c10-6-3-13(9(15)12-8(6)11)7-2-1-5(4-14)16-7/h3,5,7,14H,1-2,4H2,(H2,11,12,15)/t5-,7+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
BioChem Therapeutic Inc. Curated by ChEMBL					Assay Description Ability to inhibit the HIV-1 reverse transcriptase in cord blood mononuclear cells.				J Med Chem 38: 1-4 (1995) BindingDB Entry DOI: 10.7270/Q2VD6XHP
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50035785 (4-Amino-1-((2S,5R)-5-hydroxymethyl-tetrahydro-thio...) Show SMILES Nc1ccn([C@@H]2CC[C@H](CO)S2)c(=O)n1 Show InChI InChI=1S/C9H13N3O2S/c10-7-3-4-12(9(14)11-7)8-2-1-6(5-13)15-8/h3-4,6,8,13H,1-2,5H2,(H2,10,11,14)/t6-,8+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	287	n/a	n/a	n/a	n/a	n/a	n/a
BioChem Therapeutic Inc. Curated by ChEMBL					Assay Description Ability to inhibit the HIV-1 reverse transcriptase in cord blood mononuclear cells.				J Med Chem 38: 1-4 (1995) BindingDB Entry DOI: 10.7270/Q2VD6XHP
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50035786 (4-Amino-1-((3R,5R)-5-hydroxymethyl-tetrahydro-thio...) Show SMILES Nc1ccn([C@H]2CS[C@@H](CO)C2)c(=O)n1 Show InChI InChI=1S/C9H13N3O2S/c10-8-1-2-12(9(14)11-8)6-3-7(4-13)15-5-6/h1-2,6-7,13H,3-5H2,(H2,10,11,14)/t6-,7-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	355	n/a	n/a	n/a	n/a	n/a	n/a
BioChem Therapeutic Inc. Curated by ChEMBL					Assay Description Ability to inhibit the HIV-1 reverse transcriptase in cord blood mononuclear cells.				J Med Chem 38: 1-4 (1995) BindingDB Entry DOI: 10.7270/Q2VD6XHP
					More data for this Ligand-Target Pair