Compile Data Set for Download or QSAR

Found 465 hits with Last Name = 'focher' and Initial = 'f'   

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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195589 (2-amino-1,5-dihydro-7-[[(2S,4R)-2-(hydroxymethyl)-...) Show SMILES Nc1nc2c(CN3C[C@H](O)C[C@H]3CO)c[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C12H17N5O3/c13-12-15-9-6(2-14-10(9)11(20)16-12)3-17-4-8(19)1-7(17)5-18/h2,7-8,14,18-19H,1,3-5H2,(H3,13,15,16,20)/t7-,8+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195587 (1,4-DIDEOXY-4-AZA-1-(S)-(9-DEAZAHYPOXANTHIN-9-YL)-...) Show SMILES OC[C@H]1N[C@H]([C@H](O)[C@@H]1O)c1c[nH]c2c1nc[nH]c2=O |r| Show InChI InChI=1S/C11H14N4O4/c16-2-5-9(17)10(18)7(15-5)4-1-12-8-6(4)13-3-14-11(8)19/h1,3,5,7,9-10,12,15-18H,2H2,(H,13,14,19)/t5-,7+,9-,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair				3D Structure (crystal)
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195593 (2-amino-1,5-dihydro-7-[[(2S)-2-(hydroxymethyl)-1-p...) Show SMILES Nc1nc2c(CN3CCC[C@H]3CO)c[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C12H17N5O2/c13-12-15-9-7(4-14-10(9)11(19)16-12)5-17-3-1-2-8(17)6-18/h4,8,14,18H,1-3,5-6H2,(H3,13,15,16,19)/t8-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195597 (2-amino-1,5-dihydro-7-[[N,N-bis-[2-(hydroxy)ethyl]...) Show SMILES Nc1nc2c(CN(CCO)CCO)c[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C11H17N5O3/c12-11-14-8-7(5-13-9(8)10(19)15-11)6-16(1-3-17)2-4-18/h5,13,17-18H,1-4,6H2,(H3,12,14,15,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Thymidine kinase (Human herpesvirus 2)	BDBM21885 (2,9-disubstituted 6-oxopurine, 12i | 9-[4-(decahyd...) Show SMILES O=c1[nH]c(Nc2ccccc2)nc2n(CCCCN3CCCC4CCCCC34)cnc12 Show InChI InChI=1S/C24H32N6O/c31-23-21-22(27-24(28-23)26-19-11-2-1-3-12-19)30(17-25-21)15-7-6-14-29-16-8-10-18-9-4-5-13-20(18)29/h1-3,11-12,17-18,20H,4-10,13-16H2,(H2,26,27,28,31)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	5	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
GLSynthesis Inc.					Assay Description Recombinant HSV TKs were assayed in reaction mixture containing substrate [3H-methyl]TdR and test compounds. After reaction was stopped, the radioact...				J Med Chem 48: 3919-29 (2005) Article DOI: 10.1021/jm049059x BindingDB Entry DOI: 10.7270/Q2D21VWD
					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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195591 (2-amino-1,5-dihydro-7-[[[2-(hydroxy)ethyl]amino]me...) Show SMILES Nc1nc2c(CNCCO)c[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C9H13N5O2/c10-9-13-6-5(3-11-1-2-15)4-12-7(6)8(16)14-9/h4,11-12,15H,1-3H2,(H3,10,13,14,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	10.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					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
Thymidine kinase (Human herpesvirus 1)	BDBM21885 (2,9-disubstituted 6-oxopurine, 12i | 9-[4-(decahyd...) Show SMILES O=c1[nH]c(Nc2ccccc2)nc2n(CCCCN3CCCC4CCCCC34)cnc12 Show InChI InChI=1S/C24H32N6O/c31-23-21-22(27-24(28-23)26-19-11-2-1-3-12-19)30(17-25-21)15-7-6-14-29-16-8-10-18-9-4-5-13-20(18)29/h1-3,11-12,17-18,20H,4-10,13-16H2,(H2,26,27,28,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	30	-44.7	150	n/a	n/a	n/a	n/a	7.5	37
GLSynthesis Inc.					Assay Description Recombinant HSV TKs were assayed in reaction mixture containing substrate [3H-methyl]TdR and test compounds. After reaction was stopped, the radioact...				J Med Chem 48: 3919-29 (2005) Article DOI: 10.1021/jm049059x BindingDB Entry DOI: 10.7270/Q2D21VWD
					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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195595 (2-amino-1,5-dihydro-7-[[[N-[2-(hydroxy)ethyl]-N-me...) Show SMILES CN(CCO)Cc1c[nH]c2c1nc(N)[nH]c2=O Show InChI InChI=1S/C10H15N5O2/c1-15(2-3-16)5-6-4-12-8-7(6)13-10(11)14-9(8)17/h4,12,16H,2-3,5H2,1H3,(H3,11,13,14,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	30.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM21866 (2-phenylamino-9-(4-hydroxybutyl)-6-oxopurine | 9-(...) Show SMILES OCCCCn1cnc2c1nc(Nc1ccccc1)[nH]c2=O Show InChI InChI=1S/C15H17N5O2/c21-9-5-4-8-20-10-16-12-13(20)18-15(19-14(12)22)17-11-6-2-1-3-7-11/h1-3,6-7,10,21H,4-5,8-9H2,(H2,17,18,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards HSV-1 thymidine kinase was determined				J Med Chem 38: 49-57 (1995) BindingDB Entry DOI: 10.7270/Q2G44PBM
					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
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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	100	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 (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	110	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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195588 (2-amino-1,5-dihydro-7-[[N-[ethyl]-N-[2-(hydroxy)et...) Show SMILES CCN(CCO)Cc1c[nH]c2c1nc(N)[nH]c2=O Show InChI InChI=1S/C11H17N5O2/c1-2-16(3-4-17)6-7-5-13-9-8(7)14-11(12)15-10(9)18/h5,13,17H,2-4,6H2,1H3,(H3,12,14,15,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					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	120	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 V179D 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)	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	140	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 V179D mutant/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
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	140	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 reverse transcriptase V179D mutant				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	150	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)	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	190	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 V179D 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 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	200	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 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
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	200	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 reverse transcriptase L100I mutant				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
Thymidine kinase (Human herpesvirus 1 (strain SC16) (HHV-1) (Human h...)	BDBM50366681 (BRIVUDINE | BVDU | Bridic | Brivox | Brivudin | Br...) Show SMILES OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C=CBr)c(=O)[nH]c1=O |r,w:12.13| Show InChI InChI=1S/C11H13BrN2O5/c12-2-1-6-4-14(11(18)13-10(6)17)9-3-7(16)8(5-15)19-9/h1-2,4,7-9,15-16H,3,5H2,(H,13,17,18)/t7-,8+,9+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MMDB PC cid PC sid UniChem Similars	Article PubMed	240	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GLSynthesis Inc. Curated by ChEMBL					Assay Description Inhibition of Herpes simplex virus 1 recombinant thymidine kinase				Antimicrob Agents Chemother 51: 2028-34 (2007) Article DOI: 10.1128/AAC.01284-06 BindingDB Entry DOI: 10.7270/Q2RN38R9
					More data for this Ligand-Target Pair
Thymidine kinase (Human herpesvirus 1)	BDBM50123605 (CHEMBL3143935) Show SMILES OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2C1=NC(Nc1ccccc1)=NC2=O |r,c:10,24,t:14| Show InChI InChI=1S/C16H17N5O4/c22-7-11-10(23)6-12(25-11)21-8-17-13-14(21)19-16(20-15(13)24)18-9-4-2-1-3-5-9/h1-5,8,10-13,22-23H,6-7H2,(H,18,20,24)/t10-,11+,12+,13?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Inhibition of TdR phosphorylation using thymidine kinase assay for herpes simplex virus type 2				J Med Chem 33: 203-6 (1990) BindingDB Entry DOI: 10.7270/Q2B8573M
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195594 (2-amino-1,5-dihydro-7-[[(2S)-2-(methoxymethyl)-1-p...) Show SMILES COC[C@@H]1CCCN1Cc1c[nH]c2c1nc(N)[nH]c2=O Show InChI InChI=1S/C13H19N5O2/c1-20-7-9-3-2-4-18(9)6-8-5-15-11-10(8)16-13(14)17-12(11)19/h5,9,15H,2-4,6-7H2,1H3,(H3,14,16,17,19)/t9-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	306	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195590 (2-amino-1,5-dihydro-7-[[(2S)-2-(aminomethyl)-1-pyr...) Show SMILES NC[C@@H]1CCCN1Cc1c[nH]c2c1nc(N)[nH]c2=O Show InChI InChI=1S/C12H18N6O/c13-4-8-2-1-3-18(8)6-7-5-15-10-9(7)16-12(14)17-11(10)19/h5,8,15H,1-4,6,13H2,(H3,14,16,17,19)/t8-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	306	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50195596 (2-amino-1,5-dihydro-7-[[(2R)-2-(hydroxymethyl)-1-p...) Show SMILES Nc1nc2c(CN3CCC[C@@H]3CO)c[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C12H17N5O2/c13-12-15-9-7(4-14-10(9)11(19)16-12)5-17-3-1-2-8(17)6-18/h4,8,14,18H,1-3,5-6H2,(H3,13,15,16,19)/t8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human PNP activity				J Med Chem 49: 6037-45 (2006) Article DOI: 10.1021/jm060547+ BindingDB Entry DOI: 10.7270/Q2NV9K11
					More data for this Ligand-Target Pair
Reverse transcriptase (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	400	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)	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	400	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
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	420	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
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	420	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 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	510	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 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
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	510	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 reverse transcriptase K103N mutant				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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	510	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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	540	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 V179D 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)	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	620	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 reverse transcriptase V179D mutant				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)	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	620	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 V179D mutant/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
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	700	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 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
Thymidine kinase (Human herpesvirus 1 (strain SC16) (HHV-1) (Human h...)	BDBM50123605 (CHEMBL3143935) Show SMILES OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2C1=NC(Nc1ccccc1)=NC2=O |r,c:10,24,t:14| Show InChI InChI=1S/C16H17N5O4/c22-7-11-10(23)6-12(25-11)21-8-17-13-14(21)19-16(20-15(13)24)18-9-4-2-1-3-5-9/h1-5,8,10-13,22-23H,6-7H2,(H,18,20,24)/t10-,11+,12+,13?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Inhibition of TdR phosphorylation using thymidine kinase assay for herpes simplex virus type 2				J Med Chem 33: 203-6 (1990) BindingDB Entry DOI: 10.7270/Q2B8573M
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	700	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 reverse transcriptase L100I mutant				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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	780	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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	780	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 V179D mutant/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
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	780	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 reverse transcriptase V179D mutant				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)	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	1.04E+3	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 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	1.20E+3	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 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
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	1.20E+3	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 reverse transcriptase L100I mutant				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)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+3	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 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
Reverse transcriptase protein (Human immunodeficiency virus 1)	BDBM50339512 ((+/-)-6-Ethyl-6-[4-[(phenylthio)methyl]phenyl]-6,7...) Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccccc2)cc1 Show InChI InChI=1S/C27H23NO2S/c1-2-27(21-16-14-20(15-17-21)19-31-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)30-27/h3-18H,2,19H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+3	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 reverse transcriptase K103N mutant				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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