Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with all data for entry = 50044728   

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)	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	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027829 (CHEMBL3338540) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(N)=O)c(C)c1 Show InChI InChI=1S/C22H20N4O2/c1-13-8-14(2)21(15(3)9-13)28-19-10-20(25-12-18(19)22(24)27)26-17-6-4-16(11-23)5-7-17/h4-10,12H,1-3H3,(H2,24,27)(H,25,26)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027805 (CHEMBL3338534) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NCC#C)c(C)c1 Show InChI InChI=1S/C25H22N4O2/c1-5-10-27-25(30)21-15-28-23(29-20-8-6-19(14-26)7-9-20)13-22(21)31-24-17(3)11-16(2)12-18(24)4/h1,6-9,11-13,15H,10H2,2-4H3,(H,27,30)(H,28,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027723 (CHEMBL3338529) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(N)=O)C#N Show InChI InChI=1S/C22H17N5O2/c1-13-7-16(11-24)8-14(2)21(13)29-19-9-20(26-12-18(19)22(25)28)27-17-5-3-15(10-23)4-6-17/h3-9,12H,1-2H3,(H2,25,28)(H,26,27)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027826 (CHEMBL3338538) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NCC=C)c(C)c1 Show InChI InChI=1S/C25H24N4O2/c1-5-10-27-25(30)21-15-28-23(29-20-8-6-19(14-26)7-9-20)13-22(21)31-24-17(3)11-16(2)12-18(24)4/h5-9,11-13,15H,1,10H2,2-4H3,(H,27,30)(H,28,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027827 (CHEMBL3338539) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NCCC#N)c(C)c1 Show InChI InChI=1S/C25H23N5O2/c1-16-11-17(2)24(18(3)12-16)32-22-13-23(30-20-7-5-19(14-27)6-8-20)29-15-21(22)25(31)28-10-4-9-26/h5-8,11-13,15H,4,10H2,1-3H3,(H,28,31)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027807 (CHEMBL3338536) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NC2CC2)c(C)c1 Show InChI InChI=1S/C25H24N4O2/c1-15-10-16(2)24(17(3)11-15)31-22-12-23(28-19-6-4-18(13-26)5-7-19)27-14-21(22)25(30)29-20-8-9-20/h4-7,10-12,14,20H,8-9H2,1-3H3,(H,27,28)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027802 (CHEMBL3338531) Show SMILES CCCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(C)cc1C Show InChI InChI=1S/C25H26N4O2/c1-5-10-27-25(30)21-15-28-23(29-20-8-6-19(14-26)7-9-20)13-22(21)31-24-17(3)11-16(2)12-18(24)4/h6-9,11-13,15H,5,10H2,1-4H3,(H,27,30)(H,28,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027803 (CHEMBL3338532) Show SMILES COCCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(C)cc1C Show InChI InChI=1S/C25H26N4O3/c1-16-11-17(2)24(18(3)12-16)32-22-13-23(29-20-7-5-19(14-26)6-8-20)28-15-21(22)25(30)27-9-10-31-4/h5-8,11-13,15H,9-10H2,1-4H3,(H,27,30)(H,28,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM1434 (11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3...) Show SMILES Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12 Show InChI InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027804 (CHEMBL3338533) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NCC2CC2)c(C)c1 Show InChI InChI=1S/C26H26N4O2/c1-16-10-17(2)25(18(3)11-16)32-23-12-24(30-21-8-6-19(13-27)7-9-21)28-15-22(23)26(31)29-14-20-4-5-20/h6-12,15,20H,4-5,14H2,1-3H3,(H,28,30)(H,29,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027824 (CHEMBL3338537) Show SMILES Cc1cc(C)c(Oc2cc(Nc3ccc(cc3)C#N)ncc2C(=O)NCC2CCCO2)c(C)c1 Show InChI InChI=1S/C27H28N4O3/c1-17-11-18(2)26(19(3)12-17)34-24-13-25(31-21-8-6-20(14-28)7-9-21)29-16-23(24)27(32)30-15-22-5-4-10-33-22/h6-9,11-13,16,22H,4-5,10,15H2,1-3H3,(H,29,31)(H,30,32)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027709 (CHEMBL3338523) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NCC#C)C#N Show InChI InChI=1S/C25H19N5O2/c1-4-9-28-25(31)21-15-29-23(30-20-7-5-18(13-26)6-8-20)12-22(21)32-24-16(2)10-19(14-27)11-17(24)3/h1,5-8,10-12,15H,9H2,2-3H3,(H,28,31)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027806 (CHEMBL3338535) Show SMILES COC(CNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(C)cc1C)OC Show InChI InChI=1S/C26H28N4O4/c1-16-10-17(2)25(18(3)11-16)34-22-12-23(30-20-8-6-19(13-27)7-9-20)28-14-21(22)26(31)29-15-24(32-4)33-5/h6-12,14,24H,15H2,1-5H3,(H,28,30)(H,29,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027713 (CHEMBL3338527) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NCC=C)C#N Show InChI InChI=1S/C25H21N5O2/c1-4-9-28-25(31)21-15-29-23(30-20-7-5-18(13-26)6-8-20)12-22(21)32-24-16(2)10-19(14-27)11-17(24)3/h4-8,10-12,15H,1,9H2,2-3H3,(H,28,31)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027711 (CHEMBL3338525) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NC1CC1)C#N Show InChI InChI=1S/C25H21N5O2/c1-15-9-18(13-27)10-16(2)24(15)32-22-11-23(29-19-5-3-17(12-26)4-6-19)28-14-21(22)25(31)30-20-7-8-20/h3-6,9-11,14,20H,7-8H2,1-2H3,(H,28,29)(H,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027801 (CHEMBL3338530) Show SMILES CN(C)CCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(C)cc1C Show InChI InChI=1S/C26H29N5O2/c1-17-12-18(2)25(19(3)13-17)33-23-14-24(30-21-8-6-20(15-27)7-9-21)29-16-22(23)26(32)28-10-11-31(4)5/h6-9,12-14,16H,10-11H2,1-5H3,(H,28,32)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027719 (CHEMBL3338528) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NCCC#N)C#N Show InChI InChI=1S/C25H20N6O2/c1-16-10-19(14-28)11-17(2)24(16)33-22-12-23(31-20-6-4-18(13-27)5-7-20)30-15-21(22)25(32)29-9-3-8-26/h4-7,10-12,15H,3,9H2,1-2H3,(H,29,32)(H,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027706 (CHEMBL3338520) Show SMILES CCCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(cc1C)C#N Show InChI InChI=1S/C25H23N5O2/c1-4-9-28-25(31)21-15-29-23(30-20-7-5-18(13-26)6-8-20)12-22(21)32-24-16(2)10-19(14-27)11-17(24)3/h5-8,10-12,15H,4,9H2,1-3H3,(H,28,31)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027708 (CHEMBL3338522) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NCC1CC1)C#N Show InChI InChI=1S/C26H23N5O2/c1-16-9-20(13-28)10-17(2)25(16)33-23-11-24(31-21-7-5-18(12-27)6-8-21)29-15-22(23)26(32)30-14-19-3-4-19/h5-11,15,19H,3-4,14H2,1-2H3,(H,29,31)(H,30,32)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027712 (CHEMBL3338526) Show SMILES Cc1cc(cc(C)c1Oc1cc(Nc2ccc(cc2)C#N)ncc1C(=O)NCC1CCCO1)C#N Show InChI InChI=1S/C27H25N5O3/c1-17-10-20(14-29)11-18(2)26(17)35-24-12-25(32-21-7-5-19(13-28)6-8-21)30-16-23(24)27(33)31-15-22-4-3-9-34-22/h5-8,10-12,16,22H,3-4,9,15H2,1-2H3,(H,30,32)(H,31,33)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027707 (CHEMBL3338521) Show SMILES COCCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(cc1C)C#N Show InChI InChI=1S/C25H23N5O3/c1-16-10-19(14-27)11-17(2)24(16)33-22-12-23(30-20-6-4-18(13-26)5-7-20)29-15-21(22)25(31)28-8-9-32-3/h4-7,10-12,15H,8-9H2,1-3H3,(H,28,31)(H,29,30)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027710 (CHEMBL3338524) Show SMILES COC(CNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(cc1C)C#N)OC Show InChI InChI=1S/C26H25N5O4/c1-16-9-19(13-28)10-17(2)25(16)35-22-11-23(31-20-7-5-18(12-27)6-8-20)29-14-21(22)26(32)30-15-24(33-3)34-4/h5-11,14,24H,15H2,1-4H3,(H,29,31)(H,30,32)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50027704 (CHEMBL3338519) Show SMILES CN(C)CCNC(=O)c1cnc(Nc2ccc(cc2)C#N)cc1Oc1c(C)cc(cc1C)C#N Show InChI InChI=1S/C26H26N6O2/c1-17-11-20(15-28)12-18(2)25(17)34-23-13-24(31-21-7-5-19(14-27)6-8-21)30-16-22(23)26(33)29-9-10-32(3)4/h5-8,11-13,16H,9-10H2,1-4H3,(H,29,33)(H,30,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase assessed as reduction in biotin-dUTP incorporation using poly(rA)-oligo(dT) as template/primer and digoxigen...				Eur J Med Chem 87: 52-62 (2014) Article DOI: 10.1016/j.ejmech.2014.09.054 BindingDB Entry DOI: 10.7270/Q2NP260N
					More data for this Ligand-Target Pair