Compile Data Set for Download or QSAR

Found 475 hits with Last Name = 'samuele' and Initial = 'a'   

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 (Human immunodeficiency virus 1)	BDBM50477178 (CHEMBL239063) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCOCC1)c1c(F)cccc1F Show InChI InChI=1S/C17H19F2N3O2/c1-10(14-12(18)4-3-5-13(14)19)15-11(2)16(23)21-17(20-15)22-6-8-24-9-7-22/h3-5,10H,6-9H2,1-2H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA-dNTP ternary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2325 (2-(cyclopentylsulfanyl)-6-[1-(2,6-difluorophenyl)e...) Show SMILES CC(c1nc(SC2CCCC2)[nH]c(=O)c1C)c1c(F)cccc1F Show InChI InChI=1S/C18H20F2N2OS/c1-10(15-13(19)8-5-9-14(15)20)16-11(2)17(23)22-18(21-16)24-12-6-3-4-7-12/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,21,22,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477201 (CHEMBL394990) Show SMILES CCCN(C)c1nc(Cc2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-4-8-21(3)16-19-14(10(2)15(22)20-16)9-11-12(17)6-5-7-13(11)18/h5-7H,4,8-9H2,1-3H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA binary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA-dNTP ternary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 free reverse transcriptase				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477199 (CHEMBL239342) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCCCC1)c1c(F)cccc1F Show InChI InChI=1S/C18H21F2N3O/c1-11(15-13(19)7-6-8-14(15)20)16-12(2)17(24)22-18(21-16)23-9-4-3-5-10-23/h6-8,11H,3-5,9-10H2,1-2H3,(H,21,22,24)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477179 (CHEMBL399016) Show SMILES Cc1c(Cc2c(F)cccc2F)nc([nH]c1=O)N1CCN(CC1)c1ccccn1 Show InChI InChI=1S/C21H21F2N5O/c1-14-18(13-15-16(22)5-4-6-17(15)23)25-21(26-20(14)29)28-11-9-27(10-12-28)19-7-2-3-8-24-19/h2-8H,9-13H2,1H3,(H,25,26,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477179 (CHEMBL399016) Show SMILES Cc1c(Cc2c(F)cccc2F)nc([nH]c1=O)N1CCN(CC1)c1ccccn1 Show InChI InChI=1S/C21H21F2N5O/c1-14-18(13-15-16(22)5-4-6-17(15)23)25-21(26-20(14)29)28-11-9-27(10-12-28)19-7-2-3-8-24-19/h2-8H,9-13H2,1H3,(H,25,26,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339536 ((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(F)cc2Cl)cc1 Show InChI InChI=1S/C27H21ClFNO2S/c1-2-27(26(31)23-7-5-15-30(23)22-6-3-4-8-24(22)32-27)19-11-9-18(10-12-19)17-33-25-14-13-20(29)16-21(25)28/h3-16H,2,17H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
2-Universit£ di Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 wild type reverse transcriptase/poly(rA)/oligo(dT) DNA/dTTP ternary complex				Bioorg Med Chem Lett 21: 3935-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.020 BindingDB Entry DOI: 10.7270/Q2319ZQ9
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50339536 ((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(F)cc2Cl)cc1 Show InChI InChI=1S/C27H21ClFNO2S/c1-2-27(26(31)23-7-5-15-30(23)22-6-3-4-8-24(22)32-27)19-11-9-18(10-12-19)17-33-25-14-13-20(29)16-21(25)28/h3-16H,2,17H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
2-Universit£ di Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase K103N mutant/poly(rA)/oligo(dT) DNA/dTTP ternary complex				Bioorg Med Chem Lett 21: 3935-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.020 BindingDB Entry DOI: 10.7270/Q2319ZQ9
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477199 (CHEMBL239342) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCCCC1)c1c(F)cccc1F Show InChI InChI=1S/C18H21F2N3O/c1-11(15-13(19)7-6-8-14(15)20)16-12(2)17(24)22-18(21-16)23-9-4-3-5-10-23/h6-8,11H,3-5,9-10H2,1-2H3,(H,21,22,24)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477188 (CHEMBL239337) Show SMILES CCN(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-5-21(4)16-19-14(10(3)15(22)20-16)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477198 (CHEMBL239064) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCSCC1)c1c(F)cccc1F Show InChI InChI=1S/C17H19F2N3OS/c1-10(14-12(18)4-3-5-13(14)19)15-11(2)16(23)21-17(20-15)22-6-8-24-9-7-22/h3-5,10H,6-9H2,1-2H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477188 (CHEMBL239337) Show SMILES CCN(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-5-21(4)16-19-14(10(3)15(22)20-16)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477200 (CHEMBL396816) Show SMILES CCCN(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C17H21F2N3O/c1-5-9-22(4)17-20-15(11(3)16(23)21-17)10(2)14-12(18)7-6-8-13(14)19/h6-8,10H,5,9H2,1-4H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477200 (CHEMBL396816) Show SMILES CCCN(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C17H21F2N3O/c1-5-9-22(4)17-20-15(11(3)16(23)21-17)10(2)14-12(18)7-6-8-13(14)19/h6-8,10H,5,9H2,1-4H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477185 (CHEMBL239338) Show SMILES CC(C)N(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C17H21F2N3O/c1-9(2)22(5)17-20-15(11(4)16(23)21-17)10(3)14-12(18)7-6-8-13(14)19/h6-10H,1-5H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477196 (CHEMBL393696) Show SMILES CCC(c1cc(=O)[nH]c(n1)N(C)C)c1c(F)cccc1F Show InChI InChI=1S/C15H17F2N3O/c1-4-9(14-10(16)6-5-7-11(14)17)12-8-13(21)19-15(18-12)20(2)3/h5-9H,4H2,1-3H3,(H,18,19,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM2325 (2-(cyclopentylsulfanyl)-6-[1-(2,6-difluorophenyl)e...) Show SMILES CC(c1nc(SC2CCCC2)[nH]c(=O)c1C)c1c(F)cccc1F Show InChI InChI=1S/C18H20F2N2OS/c1-10(15-13(19)8-5-9-14(15)20)16-11(2)17(23)22-18(21-16)24-12-6-3-4-7-12/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,21,22,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase K103N mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027] (Human immunodeficiency virus type 1 group M subtyp...)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	30	-44.7	n/a	n/a	n/a	n/a	n/a	7.5	37
Universita di Siena					Assay Description The inhibition of the RNA-dependent DNA polymerase activity of the HIV-1 reverse transcriptase enzyme was measured using a primer extension assay. Th...				J Med Chem 52: 1224-8 (2009) Article DOI: 10.1021/jm801395v BindingDB Entry DOI: 10.7270/Q237772D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477186 (CHEMBL238907) Show SMILES CCc1c(nc([nH]c1=O)N(C)C)C(C)c1c(F)cccc1F Show InChI InChI=1S/C16H19F2N3O/c1-5-10-14(19-16(21(3)4)20-15(10)22)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V179D mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 free reverse transcriptase				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase K103N mutant-DNA-dNTP ternary complex expressed in Escherichia coli BL21				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA binary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479680 (CHEMBL459082) Show SMILES [H][C@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16-,18-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA binary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50339522 ((+/-)-6-Ethyl-6-[4-[(4-bromophenylthio)methyl]phen...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(Br)cc2)cc1 Show InChI InChI=1S/C27H22BrNO2S/c1-2-27(20-11-9-19(10-12-20)18-32-22-15-13-21(28)14-16-22)26(30)24-7-5-17-29(24)23-6-3-4-8-25(23)31-27/h3-17H,2,18H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
2-Universit£ di Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase L100I mutant/poly(rA)/oligo(dT) DNA/dTTP ternary complex				Bioorg Med Chem Lett 21: 3935-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.020 BindingDB Entry DOI: 10.7270/Q2319ZQ9
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477198 (CHEMBL239064) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCSCC1)c1c(F)cccc1F Show InChI InChI=1S/C17H19F2N3OS/c1-10(14-12(18)4-3-5-13(14)19)15-11(2)16(23)21-17(20-15)22-6-8-24-9-7-22/h3-5,10H,6-9H2,1-2H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477189 (CHEMBL239281) Show SMILES CCCNc1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-4-8-19-16-20-14(10(3)15(22)21-16)9(2)13-11(17)6-5-7-12(13)18/h5-7,9H,4,8H2,1-3H3,(H2,19,20,21,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477189 (CHEMBL239281) Show SMILES CCCNc1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-4-8-19-16-20-14(10(3)15(22)21-16)9(2)13-11(17)6-5-7-12(13)18/h5-7,9H,4,8H2,1-3H3,(H2,19,20,21,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027,V694A]/[588-1147,V694A] (Human immunodeficiency virus type 1)	BDBM2483 ((4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluor...) Show SMILES FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC1CC1 |r| Show InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita di Siena					Assay Description The inhibition of the RNA-dependent DNA polymerase activity of the HIV-1 reverse transcriptase enzyme was measured using a primer extension assay. Th...				J Med Chem 52: 1224-8 (2009) Article DOI: 10.1021/jm801395v BindingDB Entry DOI: 10.7270/Q237772D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477188 (CHEMBL239337) Show SMILES CCN(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C16H19F2N3O/c1-5-21(4)16-19-14(10(3)15(22)20-16)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477185 (CHEMBL239338) Show SMILES CC(C)N(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C17H21F2N3O/c1-9(2)22(5)17-20-15(11(4)16(23)21-17)10(3)14-12(18)7-6-8-13(14)19/h6-10H,1-5H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase K103N mutant-DNA binary complex expressed in Escherichia coli BL21				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479680 (CHEMBL459082) Show SMILES [H][C@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16-,18-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 reverse transcriptase-DNA-dNTP ternary complex				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50479680 (CHEMBL459082) Show SMILES [H][C@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16-,18-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 free reverse transcriptase				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477186 (CHEMBL238907) Show SMILES CCc1c(nc([nH]c1=O)N(C)C)C(C)c1c(F)cccc1F Show InChI InChI=1S/C16H19F2N3O/c1-5-10-14(19-16(21(3)4)20-15(10)22)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477179 (CHEMBL399016) Show SMILES Cc1c(Cc2c(F)cccc2F)nc([nH]c1=O)N1CCN(CC1)c1ccccn1 Show InChI InChI=1S/C21H21F2N5O/c1-14-18(13-15-16(22)5-4-6-17(15)23)25-21(26-20(14)29)28-11-9-27(10-12-28)19-7-2-3-8-24-19/h2-8H,9-13H2,1H3,(H,25,26,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477180 (CHEMBL238701) Show SMILES Cc1c(Cc2c(F)cccc2F)nc([nH]c1=O)N1CCOCC1 Show InChI InChI=1S/C16H17F2N3O2/c1-10-14(9-11-12(17)3-2-4-13(11)18)19-16(20-15(10)22)21-5-7-23-8-6-21/h2-4H,5-9H2,1H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477186 (CHEMBL238907) Show SMILES CCc1c(nc([nH]c1=O)N(C)C)C(C)c1c(F)cccc1F Show InChI InChI=1S/C16H19F2N3O/c1-5-10-14(19-16(21(3)4)20-15(10)22)9(2)13-11(17)7-6-8-12(13)18/h6-9H,5H2,1-4H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477198 (CHEMBL239064) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCSCC1)c1c(F)cccc1F Show InChI InChI=1S/C17H19F2N3OS/c1-10(14-12(18)4-3-5-13(14)19)15-11(2)16(23)21-17(20-15)22-6-8-24-9-7-22/h3-5,10H,6-9H2,1-2H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50479681 (CHEMBL478258) Show SMILES [H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H24F2N2O2S/c1-13(21-19(25)5-4-6-20(21)26)22-14(2)23(29)28-24(27-22)31-12-16-11-18(16)15-7-9-17(30-3)10-8-15/h4-10,13,16,18H,11-12H2,1-3H3,(H,27,28,29)/t13-,16+,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant free reverse transcriptase K103N mutant expressed in Escherichia coli BL21				J Med Chem 52: 840-51 (2009) Article DOI: 10.1021/jm801330n BindingDB Entry DOI: 10.7270/Q22V2JXB
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477199 (CHEMBL239342) Show SMILES CC(c1nc([nH]c(=O)c1C)N1CCCCC1)c1c(F)cccc1F Show InChI InChI=1S/C18H21F2N3O/c1-11(15-13(19)7-6-8-14(15)20)16-12(2)17(24)22-18(21-16)23-9-4-3-5-10-23/h6-8,11H,3-5,9-10H2,1-2H3,(H,21,22,24)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477197 (CHEMBL391164) Show SMILES CN(C)c1nc(Cc2c(F)cccc2F)cc(=O)[nH]1 Show InChI InChI=1S/C13H13F2N3O/c1-18(2)13-16-8(7-12(19)17-13)6-9-10(14)4-3-5-11(9)15/h3-5,7H,6H2,1-2H3,(H,16,17,19)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 3B reverse transcriptase				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50477185 (CHEMBL239338) Show SMILES CC(C)N(C)c1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C17H21F2N3O/c1-9(2)22(5)17-20-15(11(4)16(23)21-17)10(3)14-12(18)7-6-8-13(14)19/h6-10H,1-5H3,(H,20,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase K103N mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50477195 (CHEMBL239120) Show SMILES Cc1c(Cc2c(F)cccc2F)nc([nH]c1=O)N1CCSCC1 Show InChI InChI=1S/C16H17F2N3OS/c1-10-14(9-11-12(17)3-2-4-13(11)18)19-16(20-15(10)22)21-5-7-23-8-6-21/h2-4H,5-9H2,1H3,(H,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase V106A mutant				J Med Chem 50: 5412-24 (2007) Article DOI: 10.1021/jm070811e BindingDB Entry DOI: 10.7270/Q2H99803
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339536 ((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(F)cc2Cl)cc1 Show InChI InChI=1S/C27H21ClFNO2S/c1-2-27(26(31)23-7-5-15-30(23)22-6-3-4-8-24(22)32-27)19-11-9-18(10-12-19)17-33-25-14-13-20(29)16-21(25)28/h3-16H,2,17H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
2-Universit£ di Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 free wild type reverse transcriptase				Bioorg Med Chem Lett 21: 3935-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.020 BindingDB Entry DOI: 10.7270/Q2319ZQ9
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339536 ((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(F)cc2Cl)cc1 Show InChI InChI=1S/C27H21ClFNO2S/c1-2-27(26(31)23-7-5-15-30(23)22-6-3-4-8-24(22)32-27)19-11-9-18(10-12-19)17-33-25-14-13-20(29)16-21(25)28/h3-16H,2,17H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
2-Universit£ di Siena Curated by ChEMBL					Assay Description Inhibition of HIV1 wild type reverse transcriptase/poly(rA)/oligo(dT) DNA binary complex				Bioorg Med Chem Lett 21: 3935-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.020 BindingDB Entry DOI: 10.7270/Q2319ZQ9
					More data for this Ligand-Target Pair

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