Compile Data Set for Download or QSAR

Found 89 hits with Last Name = 'deng' and Initial = 'bl'   

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)	BDBM50476397 (CHEMBL226735) Show SMILES COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C26H29NO7/c1-15-11-17(13-20(23(15)32-5)25(29)33-6)19(9-7-8-10-22(28)31-4)18-12-16(2)24-21(14-18)27(3)26(30)34-24/h9,11-14H,7-8,10H2,1-6H3/b19-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193526 (CHEMBL212448 | methyl 5-(1-(3,7-dimethyl-2-oxo-2,3...) Show SMILES COC(=O)CCC\C=C(\c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C26H29NO7/c1-15-11-17(13-20(23(15)32-5)25(29)33-6)19(9-7-8-10-22(28)31-4)18-12-16(2)24-21(14-18)27(3)26(30)34-24/h9,11-14H,7-8,10H2,1-6H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank 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
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM2809 (Alkenyldiarylmethanes (ADAM) 6b | CHEMBL105859 | M...) Show SMILES COC(=O)CCC\C=C(\c1ccc(OC)c(OC)c1)c1cc(C)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C25H30O7/c1-16-13-18(14-20(24(16)31-5)25(27)32-6)19(9-7-8-10-23(26)30-4)17-11-12-21(28-2)22(15-17)29-3/h9,11-15H,7-8,10H2,1-6H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	74	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50480355 (CHEMBL514984) Show SMILES COC(=O)CCC\C=C(\c1cc(C)c2onc(OC)c2c1)c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C25H26N2O6/c1-14-10-16(12-19-22(14)33-26-24(19)31-5)18(8-6-7-9-21(28)30-4)17-11-15(2)23-20(13-17)27(3)25(29)32-23/h8,10-13H,6-7,9H2,1-5H3/b18-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2753 (Alkenyldiarylmethanes (ADAM) 22 | CHEMBL294840 | M...) Show SMILES [#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]\[#6]=[#6](\c1cc(Cl)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6])-c1cc(Cl)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6] Show InChI InChI=1S/C25H26Cl2O8/c1-31-21(28)9-7-6-8-16(14-10-17(24(29)34-4)22(32-2)19(26)12-14)15-11-18(25(30)35-5)23(33-3)20(27)13-15/h8,10-13H,6-7,9H2,1-5H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM2775 (Alkenyldiarylmethane (ADAM) 17a | Alkenyldiarylmet...) Show SMILES [#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]\[#6]=[#6](/c1cc(Br)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6])-c1cc(Br)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6] Show InChI InChI=1S/C25H26Br2O8/c1-31-21(28)9-7-6-8-16(14-10-17(24(29)34-4)22(32-2)19(26)12-14)15-11-18(25(30)35-5)23(33-3)20(27)13-15/h8,10-13H,6-7,9H2,1-5H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476690 (CHEMBL243068) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCc1nnc(C)o1)\c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C26H27N3O6/c1-14-10-18(13-21(23(14)31-4)26(30)33-6)19(8-7-9-22-28-27-16(3)34-22)17-11-15(2)24-20(12-17)25(32-5)29-35-24/h8,10-13H,7,9H2,1-6H3/b19-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476687 (CHEMBL231473) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C\CCCc1nnc(C)o1)\c1ccc(cc1)C#N Show InChI InChI=1S/C25H25N3O3S/c1-16-13-20(14-22(24(16)30-3)25(29)32-4)21(19-11-9-18(15-26)10-12-19)7-5-6-8-23-28-27-17(2)31-23/h7,9-14H,5-6,8H2,1-4H3/b21-7+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476708 (CHEMBL387567) Show SMILES COc1noc2c(C)cc(cc12)C(=C\CCCc1nnc(C)o1)\c1cc(C)c(OC)c(c1)C(=O)SC Show InChI InChI=1S/C27H29N3O5S/c1-15-11-19(14-22(24(15)32-4)27(31)36-6)20(9-7-8-10-23-29-28-17(3)34-23)18-12-16(2)25-21(13-18)26(33-5)30-35-25/h9,11-14H,7-8,10H2,1-6H3/b20-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM2803 (Alkenyldiarylmethanes (ADAM) 50a | CHEMBL131761 | ...) Show SMILES [#6]-[#8]-[#6](=O)-c1cc(cc(Br)c1-[#8]-[#6])-[#6](=[#6]/[#6]-[#6]-[#7]-1-[#6]-[#6]-[#8]-[#6]-1=O)\c1cc(Br)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6] Show InChI InChI=1S/C25H25Br2NO8/c1-32-21-17(23(29)34-3)10-14(12-19(21)26)16(6-5-7-28-8-9-36-25(28)31)15-11-18(24(30)35-4)22(33-2)20(27)13-15/h6,10-13H,5,7-9H2,1-4H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	499	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476715 (CHEMBL231274) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCCc1nnc(C)o1)\c1cccc(c1)C#N Show InChI InChI=1S/C25H25N3O3S/c1-16-12-20(14-22(24(16)30-3)25(29)32-4)21(19-9-7-8-18(13-19)15-26)10-5-6-11-23-28-27-17(2)31-23/h7-10,12-14H,5-6,11H2,1-4H3/b21-10-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173813 ((E)-5-[1-(3-cyanophenyl)-5-methoxycarbonylpent-1-e...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C24H25NO5/c1-16-12-19(14-21(23(16)29-3)24(27)30-4)20(10-5-6-11-22(26)28-2)18-9-7-8-17(13-18)15-25/h7-10,12-14H,5-6,11H2,1-4H3/b20-10+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50480356 (CHEMBL515873) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCN1CCOC1=O)\c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C26H28N2O7/c1-15-11-18(14-21(22(15)31-3)25(29)33-5)19(7-6-8-28-9-10-34-26(28)30)17-12-16(2)23-20(13-17)24(32-4)27-35-23/h7,11-14H,6,8-10H2,1-5H3/b19-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193524 ((Z)-5-[1-(4-cyanophenyl)-5-methoxycarbonylpent-1-e...) Show SMILES COC(=O)CCC\C=C(\c1ccc(cc1)C#N)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C23H22N2O4/c1-15-12-18(13-20-22(15)29-25-23(20)28-3)19(6-4-5-7-21(26)27-2)17-10-8-16(14-24)9-11-17/h6,8-13H,4-5,7H2,1-3H3/b19-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173819 (3-Chloro-5-[(E)-1-(3-cyano-phenyl)-5-methoxycarbon...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(Cl)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C23H22ClNO5/c1-28-21(26)10-5-4-9-18(16-8-6-7-15(11-16)14-25)17-12-19(23(27)30-3)22(29-2)20(24)13-17/h6-9,11-13H,4-5,10H2,1-3H3/b18-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173813 ((E)-5-[1-(3-cyanophenyl)-5-methoxycarbonylpent-1-e...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C24H25NO5/c1-16-12-19(14-21(23(16)29-3)24(27)30-4)20(10-5-6-11-22(26)28-2)18-9-7-8-17(13-18)15-25/h7-10,12-14H,5-6,11H2,1-4H3/b20-10+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173820 ((Z)-6-(3-Fluoro-5-trifluoromethyl-phenyl)-6-(3-met...) Show SMILES COC(=O)CCC\C=C(/c1cc(F)cc(c1)C(F)(F)F)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C23H21F4NO4/c1-13-8-14(11-19-21(13)32-28-22(19)31-3)18(6-4-5-7-20(29)30-2)15-9-16(23(25,26)27)12-17(24)10-15/h6,8-12H,4-5,7H2,1-3H3/b18-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50173820 ((Z)-6-(3-Fluoro-5-trifluoromethyl-phenyl)-6-(3-met...) Show SMILES COC(=O)CCC\C=C(/c1cc(F)cc(c1)C(F)(F)F)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C23H21F4NO4/c1-13-8-14(11-19-21(13)32-28-22(19)31-3)18(6-4-5-7-20(29)30-2)15-9-16(23(25,26)27)12-17(24)10-15/h6,8-12H,4-5,7H2,1-3H3/b18-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476695 (CHEMBL244780) Show SMILES COc1noc2c(C)cc(cc12)C(=C\CCc1nnc(C)o1)\c1cc(C)c(OC)c(c1)C(=O)SC Show InChI InChI=1S/C26H27N3O5S/c1-14-10-18(13-21(23(14)31-4)26(30)35-6)19(8-7-9-22-28-27-16(3)33-22)17-11-15(2)24-20(12-17)25(32-5)29-34-24/h8,10-13H,7,9H2,1-6H3/b19-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476697 (CHEMBL231470) Show SMILES COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C26H29NO7/c1-15-11-18(14-21(23(15)31-4)26(29)33-6)19(9-7-8-10-22(28)30-3)17-12-16(2)24-20(13-17)25(32-5)27-34-24/h9,11-14H,7-8,10H2,1-6H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476697 (CHEMBL231470) Show SMILES COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C26H29NO7/c1-15-11-18(14-21(23(15)31-4)26(29)33-6)19(9-7-8-10-22(28)30-3)17-12-16(2)24-20(13-17)25(32-5)27-34-24/h9,11-14H,7-8,10H2,1-6H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50480357 (CHEMBL475260) Show SMILES [#6]-[#8]-c1noc2c(-[#6])cc(cc12)-[#6](=[#6]/[#6]-[#6]-[#7]-1-[#6]-[#6]-[#8]-[#6]-1=O)\c1cc(-[#6])c2onc(-[#8]-[#6])c2c1 Show InChI InChI=1S/C25H25N3O6/c1-14-10-16(12-19-21(14)33-26-23(19)30-3)18(6-5-7-28-8-9-32-25(28)29)17-11-15(2)22-20(13-17)24(31-4)27-34-22/h6,10-13H,5,7-9H2,1-4H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173810 (5-[(E)-1-(3,4-Dimethoxy-phenyl)-4-(2-oxo-oxazolidi...) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCN1CCOC1=O)\c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C25H29NO7/c1-16-13-18(14-20(23(16)31-4)24(27)32-5)19(7-6-10-26-11-12-33-25(26)28)17-8-9-21(29-2)22(15-17)30-3/h7-9,13-15H,6,10-12H2,1-5H3/b19-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476710 (CHEMBL243277) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C\CCc1nnc(C)o1)\c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C26H27N3O6/c1-14-10-17(12-20(23(14)32-5)25(30)33-6)19(8-7-9-22-28-27-16(3)34-22)18-11-15(2)24-21(13-18)29(4)26(31)35-24/h8,10-13H,7,9H2,1-6H3/b19-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193525 ((Z)-6-(4-cyanophenyl)-6-(2,3-dihydro-3,7-dimethyl-...) Show SMILES COC(=O)CCC\C=C(\c1ccc(cc1)C#N)c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C23H22N2O4/c1-15-12-18(13-20-22(15)29-23(27)25(20)2)19(6-4-5-7-21(26)28-3)17-10-8-16(14-24)9-11-17/h6,8-13H,4-5,7H2,1-3H3/b19-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank 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
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193519 (5-[1-(2,3-dihydro-2,7-dimethyl-3-oxobenzo[d]isoxaz...) Show SMILES COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C26H29NO7/c1-15-11-18(14-21(23(15)32-5)26(30)33-6)19(9-7-8-10-22(28)31-4)17-12-16(2)24-20(13-17)25(29)27(3)34-24/h9,11-14H,7-8,10H2,1-6H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476719 (CHEMBL244781) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C\CCc1nnc(C)o1)\c1ccc2oc(=O)n(C)c2c1 Show InChI InChI=1S/C25H25N3O5S/c1-14-11-17(12-19(23(14)31-4)24(29)34-5)18(7-6-8-22-27-26-15(2)32-22)16-9-10-21-20(13-16)28(3)25(30)33-21/h7,9-13H,6,8H2,1-5H3/b18-7+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193521 ((Z)-6-(3-cyanophenyl)-6-(2,3-dihydro-3,7-dimethyl-...) Show SMILES COC(=O)CCC\C=C(\c1cccc(c1)C#N)c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C23H22N2O4/c1-15-11-18(13-20-22(15)29-23(27)25(20)2)19(9-4-5-10-21(26)28-3)17-8-6-7-16(12-17)14-24/h6-9,11-13H,4-5,10H2,1-3H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM50259880 (3alpha-acetoxy-27-hydroxylup-20(29)-en-24-oic acid...) Show SMILES CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(CO)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](OC(C)=O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]12 |r| Show InChI InChI=1S/C32H50O5/c1-19(2)21-10-13-28(4)16-17-32(18-33)22(26(21)28)8-9-23-29(5)14-12-25(37-20(3)34)31(7,27(35)36)24(29)11-15-30(23,32)6/h21-26,33H,1,8-18H2,2-7H3,(H,35,36)/t21-,22+,23+,24+,25+,26+,28+,29+,30+,31+,32-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of prolyl endopeptidase				J Nat Prod 68: 189-93 (2005) Article DOI: 10.1021/np040142x BindingDB Entry DOI: 10.7270/Q22V2H18
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476686 (CHEMBL231275) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCCc1nnc(C)o1)\c1ccc(cc1)C#N Show InChI InChI=1S/C25H25N3O3S/c1-16-13-20(14-22(24(16)30-3)25(29)32-4)21(19-11-9-18(15-26)10-12-19)7-5-6-8-23-28-27-17(2)31-23/h7,9-14H,5-6,8H2,1-4H3/b21-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50480358 (CHEMBL475261) Show SMILES COc1noc2c(C)cc(cc12)C(=C/CCN1CCOC1=O)\c1cc(C)c2oc(=O)n(C)c2c1 Show InChI InChI=1S/C25H25N3O6/c1-14-10-16(12-19-21(14)34-26-23(19)31-4)18(6-5-7-28-8-9-32-25(28)30)17-11-15(2)22-20(13-17)27(3)24(29)33-22/h6,10-13H,5,7-9H2,1-4H3/b18-6+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476711 (CHEMBL387804) Show SMILES COc1noc2c(C)cc(cc12)C(=C/CCCc1nnc(C)o1)\c1cc(C)c(OC)c(c1)C(=O)SC Show InChI InChI=1S/C27H29N3O5S/c1-15-11-19(14-22(24(15)32-4)27(31)36-6)20(9-7-8-10-23-29-28-17(3)34-23)18-12-16(2)25-21(13-18)26(33-5)30-35-25/h9,11-14H,7-8,10H2,1-6H3/b20-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173808 ((E)-6-(3-Cyano-phenyl)-6-(3-methoxy-7-methyl-benzo...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C23H22N2O4/c1-15-11-18(13-20-22(15)29-25-23(20)28-3)19(9-4-5-10-21(26)27-2)17-8-6-7-16(12-17)14-24/h6-9,11-13H,4-5,10H2,1-3H3/b19-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50480352 (CHEMBL475418) Show SMILES COC(=O)c1cc(cc(Cl)c1OC)C(=C\CCN1CCOC1=O)\c1cc(C)c2onc(OC)c2c1 Show InChI InChI=1S/C25H25ClN2O7/c1-14-10-15(11-18-21(14)35-27-23(18)32-3)17(6-5-7-28-8-9-34-25(28)30)16-12-19(24(29)33-4)22(31-2)20(26)13-16/h6,10-13H,5,7-9H2,1-4H3/b17-6+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase assessed as incorporation of [32P]GTP into poly(rC).oligo(dG) (rCdG) homopolymer template primer				Eur J Med Chem 44: 1210-4 (2009) Article DOI: 10.1016/j.ejmech.2008.09.013 BindingDB Entry DOI: 10.7270/Q20R9S6T
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476693 (CHEMBL244999) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCc1nnc(C)o1)\c1ccc(cc1)C#N Show InChI InChI=1S/C24H23N3O3S/c1-15-12-19(13-21(23(15)29-3)24(28)31-4)20(18-10-8-17(14-25)9-11-18)6-5-7-22-27-26-16(2)30-22/h6,8-13H,5,7H2,1-4H3/b20-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476688 (CHEMBL231072) Show SMILES [#6]-[#8]-c1c(-[#6])cc(cc1-[#6](=O)-[#16]-[#6])-[#6](=[#6]\[#6]-[#6]-[#6]-c1nnc(-[#6])o1)\c1cc(-[#6])c(-[#8]-[#6])c(c1)-[#6](=O)-[#16]-[#6] Show InChI InChI=1S/C28H32N2O5S2/c1-16-12-19(14-22(25(16)33-4)27(31)36-6)21(10-8-9-11-24-30-29-18(3)35-24)20-13-17(2)26(34-5)23(15-20)28(32)37-7/h10,12-15H,8-9,11H2,1-7H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476692 (CHEMBL243067) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCc1nnc(C)o1)\c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C26H27N3O6/c1-14-10-18(13-21(23(14)32-5)26(31)33-6)19(8-7-9-22-28-27-16(3)34-22)17-11-15(2)24-20(12-17)25(30)29(4)35-24/h8,10-13H,7,9H2,1-6H3/b19-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Homo sapiens (Human))	BDBM35440 (ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...) Show SMILES O=c1[nH]cnc2n[nH]cc12 Show InChI InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of xanthine oxidase				J Nat Prod 68: 189-93 (2005) Article DOI: 10.1021/np040142x BindingDB Entry DOI: 10.7270/Q22V2H18
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173805 ((E)-6-(5-Chloro-2-methoxy-phenyl)-6-(3-cyano-pheny...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(Cl)ccc1OC Show InChI InChI=1S/C21H20ClNO3/c1-25-20-11-10-17(22)13-19(20)18(8-3-4-9-21(24)26-2)16-7-5-6-15(12-16)14-23/h5-8,10-13H,3-4,9H2,1-2H3/b18-8+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193520 ((E)-5-[1-(3-methoxy-7-methyl-benzo[d]isoxazol-5-yl...) Show SMILES COc1noc2c(C)cc(cc12)C(=C/CCN1CCOC1=O)\c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C25H25N3O6/c1-14-10-16(12-19-21(14)33-26-23(19)31-4)18(6-5-7-28-8-9-32-25(28)30)17-11-15(2)22-20(13-17)24(29)27(3)34-22/h6,10-13H,5,7-9H2,1-4H3/b18-6+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476707 (CHEMBL245218) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCc1nnc(C)o1)\c1ccc2oncc2c1 Show InChI InChI=1S/C24H23N3O4S/c1-14-10-17(12-20(23(14)29-3)24(28)32-4)19(6-5-7-22-27-26-15(2)30-22)16-8-9-21-18(11-16)13-25-31-21/h6,8-13H,5,7H2,1-4H3/b19-6-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476706 (CHEMBL242843) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCc1nnn(C)n1)\c1cccc(c1)C#N Show InChI InChI=1S/C23H23N5O3/c1-15-11-18(13-20(22(15)30-3)23(29)31-4)19(17-8-5-7-16(12-17)14-24)9-6-10-21-25-27-28(2)26-21/h5,7-9,11-13H,6,10H2,1-4H3/b19-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476713 (CHEMBL231377) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C\CCCc1nnc(C)o1)\c1cccc(c1)C#N Show InChI InChI=1S/C25H25N3O3S/c1-16-12-20(14-22(24(16)30-3)25(29)32-4)21(19-9-7-8-18(13-19)15-26)10-5-6-11-23-28-27-17(2)31-23/h7-10,12-14H,5-6,11H2,1-4H3/b21-10+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM50241262 ((3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bS)-3-a...) Show SMILES C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@@H](OC(C)=O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C |r,c:10| Show InChI InChI=1S/C32H48O5/c1-18-9-12-28(4)15-16-30(6)21(25(28)19(18)2)17-22(34)26-29(5)13-11-24(37-20(3)33)32(8,27(35)36)23(29)10-14-31(26,30)7/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23-,24-,25+,26-,28-,29+,30-,31-,32-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	7.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of prolyl endopeptidase				J Nat Prod 68: 189-93 (2005) Article DOI: 10.1021/np040142x BindingDB Entry DOI: 10.7270/Q22V2H18
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173811 ((Z)-6-(5-Chloro-2-methoxy-phenyl)-6-(2,7-dimethyl-...) Show SMILES COC(=O)CCC\C=C(\c1cc(C)c2on(C)c(=O)c2c1)c1cc(Cl)ccc1OC Show InChI InChI=1S/C23H24ClNO5/c1-14-11-15(12-19-22(14)30-25(2)23(19)27)17(7-5-6-8-21(26)29-4)18-13-16(24)9-10-20(18)28-3/h7,9-13H,5-6,8H2,1-4H3/b17-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476717 (CHEMBL438127) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCc1nnc(C)o1)\c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C26H27N3O5S/c1-14-10-18(13-21(23(14)32-5)26(31)35-6)19(8-7-9-22-28-27-16(3)33-22)17-11-15(2)24-20(12-17)25(30)29(4)34-24/h8,10-13H,7,9H2,1-6H3/b19-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50476700 (CHEMBL244998) Show SMILES COc1c(C)cc(cc1C(=O)SC)C(=C/CCc1nnc(C)o1)\c1cccc(c1)C#N Show InChI InChI=1S/C24H23N3O3S/c1-15-11-19(13-21(23(15)29-3)24(28)31-4)20(18-8-5-7-17(12-18)14-25)9-6-10-22-27-26-16(2)30-22/h5,7-9,11-13H,6,10H2,1-4H3/b20-9-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase				J Med Chem 50: 4854-67 (2007) Article DOI: 10.1021/jm070382k BindingDB Entry DOI: 10.7270/Q2N58Q4R
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM50241260 ((3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-3-h...) Show SMILES C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C |r,c:10| Show InChI InChI=1S/C30H48O3/c1-18-10-13-26(3)16-17-28(5)20(24(26)19(18)2)8-9-21-27(4)14-12-23(31)30(7,25(32)33)22(27)11-15-29(21,28)6/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21-,22-,23-,24+,26-,27-,28-,29-,30-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of prolyl endopeptidase				J Nat Prod 68: 189-93 (2005) Article DOI: 10.1021/np040142x BindingDB Entry DOI: 10.7270/Q22V2H18
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50193527 ((Z)-5-[1-(2,3-dihydro-2,7-dimethyl-3-oxobenzo[d]is...) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCN1CCOC1=O)\c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C26H28N2O7/c1-15-11-18(14-21(22(15)32-4)25(30)33-5)19(7-6-8-28-9-10-34-26(28)31)17-12-16(2)23-20(13-17)24(29)27(3)35-23/h7,11-14H,6,8-10H2,1-5H3/b19-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50173818 (5-[(E)-1-(3-Fluoro-5-trifluoromethyl-phenyl)-4-(2-...) Show SMILES COC(=O)c1cc(cc(C)c1OC)C(=C/CCN1CCOC1=O)\c1cc(F)cc(c1)C(F)(F)F Show InChI InChI=1S/C24H23F4NO5/c1-14-9-15(12-20(21(14)32-2)22(30)33-3)19(5-4-6-29-7-8-34-23(29)31)16-10-17(24(26,27)28)13-18(25)11-16/h5,9-13H,4,6-8H2,1-3H3/b19-5+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair

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