Compile Data Set for Download or QSAR

Found 62 hits with Last Name = 'vechi' and Initial = 'sm'   

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
Genome polyprotein (West Nile virus)	BDBM50109138 (CHEMBL3601351) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC3CCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C38H51N9O6S/c39-20-8-7-14-28(35(51)46-31(32(40)48)26-12-5-2-6-13-26)45-34(50)29(15-9-21-43-37(41)42)44-33(49)27-18-16-24(17-19-27)22-30-36(52)47(38(53)54-30)23-25-10-3-1-4-11-25/h2,5-6,12-13,16-19,22,25,28-29,31H,1,3-4,7-11,14-15,20-21,23,39H2,(H2,40,48)(H,44,49)(H,45,50)(H,46,51)(H4,41,42,43)/b30-22-/t28-,29-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109138 (CHEMBL3601351) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC3CCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C38H51N9O6S/c39-20-8-7-14-28(35(51)46-31(32(40)48)26-12-5-2-6-13-26)45-34(50)29(15-9-21-43-37(41)42)44-33(49)27-18-16-24(17-19-27)22-30-36(52)47(38(53)54-30)23-25-10-3-1-4-11-25/h2,5-6,12-13,16-19,22,25,28-29,31H,1,3-4,7-11,14-15,20-21,23,39H2,(H2,40,48)(H,44,49)(H,45,50)(H,46,51)(H4,41,42,43)/b30-22-/t28-,29-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Competitive inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50026765 (CHEMBL3335494) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C27H38N8O4/c28-16-8-7-14-20(26(39)35-22(23(29)36)18-10-3-1-4-11-18)34-25(38)21(15-9-17-32-27(30)31)33-24(37)19-12-5-2-6-13-19/h1-6,10-13,20-22H,7-9,14-17,28H2,(H2,29,36)(H,33,37)(H,34,38)(H,35,39)(H4,30,31,32)/t20-,21-,22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of West Nile virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026811 (CHEMBL3335518) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C36H47N9O6S/c37-19-7-6-13-26(33(49)44-29(30(38)46)23-9-2-1-3-10-23)43-32(48)27(14-8-20-41-35(39)40)42-31(47)24-17-15-22(16-18-24)21-28-34(50)45(36(51)52-28)25-11-4-5-12-25/h1-3,9-10,15-18,21,25-27,29H,4-8,11-14,19-20,37H2,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b28-21-/t26-,27-,29-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109138 (CHEMBL3601351) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC3CCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C38H51N9O6S/c39-20-8-7-14-28(35(51)46-31(32(40)48)26-12-5-2-6-13-26)45-34(50)29(15-9-21-43-37(41)42)44-33(49)27-18-16-24(17-19-27)22-30-36(52)47(38(53)54-30)23-25-10-3-1-4-11-25/h2,5-6,12-13,16-19,22,25,28-29,31H,1,3-4,7-11,14-15,20-21,23,39H2,(H2,40,48)(H,44,49)(H,45,50)(H,46,51)(H4,41,42,43)/b30-22-/t28-,29-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109050 (CHEMBL3601349) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC3CCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C37H49N9O6S/c38-19-7-6-13-27(34(50)45-30(31(39)47)25-11-2-1-3-12-25)44-33(49)28(14-8-20-42-36(40)41)43-32(48)26-17-15-23(16-18-26)21-29-35(51)46(37(52)53-29)22-24-9-4-5-10-24/h1-3,11-12,15-18,21,24,27-28,30H,4-10,13-14,19-20,22,38H2,(H2,39,47)(H,43,48)(H,44,49)(H,45,50)(H4,40,41,42)/b29-21-/t27-,28-,30-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109046 (CHEMBL3601345) Show SMILES CCC(CC)N1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C36H49N9O6S/c1-3-25(4-2)45-34(50)28(52-36(45)51)21-22-15-17-24(18-16-22)31(47)42-27(14-10-20-41-35(39)40)32(48)43-26(13-8-9-19-37)33(49)44-29(30(38)46)23-11-6-5-7-12-23/h5-7,11-12,15-18,21,25-27,29H,3-4,8-10,13-14,19-20,37H2,1-2H3,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b28-21-/t26-,27-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109139 (CHEMBL3601352) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CCC3CCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C39H53N9O6S/c40-21-8-7-14-29(36(52)47-32(33(41)49)27-12-5-2-6-13-27)46-35(51)30(15-9-22-44-38(42)43)45-34(50)28-18-16-26(17-19-28)24-31-37(53)48(39(54)55-31)23-20-25-10-3-1-4-11-25/h2,5-6,12-13,16-19,24-25,29-30,32H,1,3-4,7-11,14-15,20-23,40H2,(H2,41,49)(H,45,50)(H,46,51)(H,47,52)(H4,42,43,44)/b31-24-/t29-,30-,32-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109142 (CHEMBL3601354) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC34CC5CC(CC(C5)C3)C4)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r,TLB:40:31:38:34.35.36,THB:36:35:32:38.37.39,36:37:34.35.40:32,40:35:38:31.32.39,30:31:38:34.35.36| Show InChI InChI=1S/C42H55N9O6S/c43-15-5-4-9-31(38(55)50-34(35(44)52)29-7-2-1-3-8-29)49-37(54)32(10-6-16-47-40(45)46)48-36(53)30-13-11-25(12-14-30)20-33-39(56)51(41(57)58-33)24-42-21-26-17-27(22-42)19-28(18-26)23-42/h1-3,7-8,11-14,20,26-28,31-32,34H,4-6,9-10,15-19,21-24,43H2,(H2,44,52)(H,48,53)(H,49,54)(H,50,55)(H4,45,46,47)/b33-20-/t26?,27?,28?,31-,32-,34-,42?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026810 (CHEMBL3335517) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C(/C#N)C(=O)NC2CC2)cc1)C(=O)NC(C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C34H44N10O5/c35-17-5-4-9-26(33(49)44-28(29(37)45)22-7-2-1-3-8-22)43-32(48)27(10-6-18-40-34(38)39)42-30(46)23-13-11-21(12-14-23)19-24(20-36)31(47)41-25-15-16-25/h1-3,7-8,11-14,19,25-28H,4-6,9-10,15-18,35H2,(H2,37,45)(H,41,47)(H,42,46)(H,43,48)(H,44,49)(H4,38,39,40)/b24-19+/t26-,27-,28?/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109047 (CHEMBL3601346) Show SMILES CCC(CC)CN1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C37H51N9O6S/c1-3-23(4-2)22-46-35(51)29(53-37(46)52)21-24-15-17-26(18-16-24)32(48)43-28(14-10-20-42-36(40)41)33(49)44-27(13-8-9-19-38)34(50)45-30(31(39)47)25-11-6-5-7-12-25/h5-7,11-12,15-18,21,23,27-28,30H,3-4,8-10,13-14,19-20,22,38H2,1-2H3,(H2,39,47)(H,43,48)(H,44,49)(H,45,50)(H4,40,41,42)/b29-21-/t27-,28-,30-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109049 (CHEMBL3601348) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC3CCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C36H47N9O6S/c37-18-5-4-12-26(33(49)44-29(30(38)46)24-10-2-1-3-11-24)43-32(48)27(13-7-19-41-35(39)40)42-31(47)25-16-14-22(15-17-25)20-28-34(50)45(36(51)52-28)21-23-8-6-9-23/h1-3,10-11,14-17,20,23,26-27,29H,4-9,12-13,18-19,21,37H2,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b28-20-/t26-,27-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109048 (CHEMBL3601347) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C35H45N9O6S/c36-18-5-4-12-25(32(48)43-28(29(37)45)22-8-2-1-3-9-22)42-31(47)26(13-7-19-40-34(38)39)41-30(46)23-16-14-21(15-17-23)20-27-33(49)44(35(50)51-27)24-10-6-11-24/h1-3,8-9,14-17,20,24-26,28H,4-7,10-13,18-19,36H2,(H2,37,45)(H,41,46)(H,42,47)(H,43,48)(H4,38,39,40)/b27-20-/t25-,26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109112 (CHEMBL3601350) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C37H49N9O6S/c38-20-8-7-14-27(34(50)45-30(31(39)47)24-10-3-1-4-11-24)44-33(49)28(15-9-21-42-36(40)41)43-32(48)25-18-16-23(17-19-25)22-29-35(51)46(37(52)53-29)26-12-5-2-6-13-26/h1,3-4,10-11,16-19,22,26-28,30H,2,5-9,12-15,20-21,38H2,(H2,39,47)(H,43,48)(H,44,49)(H,45,50)(H4,40,41,42)/b29-22-/t27-,28-,30-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109265 (CHEMBL3601102) Show SMILES CC(C)CCN1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C36H49N9O6S/c1-22(2)17-20-45-34(50)28(52-36(45)51)21-23-13-15-25(16-14-23)31(47)42-27(12-8-19-41-35(39)40)32(48)43-26(11-6-7-18-37)33(49)44-29(30(38)46)24-9-4-3-5-10-24/h3-5,9-10,13-16,21-22,26-27,29H,6-8,11-12,17-20,37H2,1-2H3,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b28-21-/t26-,27-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109267 (CHEMBL3601104) Show SMILES CC(C)(C)CCN1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C37H51N9O6S/c1-37(2,3)18-21-46-34(51)28(53-36(46)52)22-23-14-16-25(17-15-23)31(48)43-27(13-9-20-42-35(40)41)32(49)44-26(12-7-8-19-38)33(50)45-29(30(39)47)24-10-5-4-6-11-24/h4-6,10-11,14-17,22,26-27,29H,7-9,12-13,18-21,38H2,1-3H3,(H2,39,47)(H,43,48)(H,44,49)(H,45,50)(H4,40,41,42)/b28-22-/t26-,27-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109266 (CHEMBL3601103) Show SMILES CC(C)(C)CN1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C36H49N9O6S/c1-36(2,3)21-45-33(50)27(52-35(45)51)20-22-14-16-24(17-15-22)30(47)42-26(13-9-19-41-34(39)40)31(48)43-25(12-7-8-18-37)32(49)44-28(29(38)46)23-10-5-4-6-11-23/h4-6,10-11,14-17,20,25-26,28H,7-9,12-13,18-19,21,37H2,1-3H3,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b27-20-/t25-,26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109141 (CHEMBL3601353) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCCCC3)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C38H51N9O6S/c39-21-9-8-15-28(35(51)46-31(32(40)48)25-11-4-3-5-12-25)45-34(50)29(16-10-22-43-37(41)42)44-33(49)26-19-17-24(18-20-26)23-30-36(52)47(38(53)54-30)27-13-6-1-2-7-14-27/h3-5,11-12,17-20,23,27-29,31H,1-2,6-10,13-16,21-22,39H2,(H2,40,48)(H,44,49)(H,45,50)(H,46,51)(H4,41,42,43)/b30-23-/t28-,29-,31-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109144 (CHEMBL3601356) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CCC#C)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C35H43N9O6S/c1-2-3-20-44-33(49)27(51-35(44)50)21-22-14-16-24(17-15-22)30(46)41-26(13-9-19-40-34(38)39)31(47)42-25(12-7-8-18-36)32(48)43-28(29(37)45)23-10-5-4-6-11-23/h1,4-6,10-11,14-17,21,25-26,28H,3,7-9,12-13,18-20,36H2,(H2,37,45)(H,41,46)(H,42,47)(H,43,48)(H4,38,39,40)/b27-21-/t25-,26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109143 (CHEMBL3601355) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CC#C)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C34H41N9O6S/c1-2-19-43-32(48)26(50-34(43)49)20-21-13-15-23(16-14-21)29(45)40-25(12-8-18-39-33(37)38)30(46)41-24(11-6-7-17-35)31(47)42-27(28(36)44)22-9-4-3-5-10-22/h1,3-5,9-10,13-16,20,24-25,27H,6-8,11-12,17-19,35H2,(H2,36,44)(H,40,45)(H,41,46)(H,42,47)(H4,37,38,39)/b26-20-/t24-,25-,27-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109045 (CHEMBL3601105) Show SMILES CCC(C)N1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C35H47N9O6S/c1-3-21(2)44-33(49)27(51-35(44)50)20-22-14-16-24(17-15-22)30(46)41-26(13-9-19-40-34(38)39)31(47)42-25(12-7-8-18-36)32(48)43-28(29(37)45)23-10-5-4-6-11-23/h4-6,10-11,14-17,20-21,25-26,28H,3,7-9,12-13,18-19,36H2,1-2H3,(H2,37,45)(H,41,46)(H,42,47)(H,43,48)(H4,38,39,40)/b27-20-/t21?,25-,26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026809 (CHEMBL2440353) Show SMILES CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCC3)C2=O)cc1)C(N)=O |r| Show InChI InChI=1S/C34H51N9O6S/c1-2-3-11-24(28(36)44)40-30(46)25(12-6-7-18-35)42-31(47)26(13-8-19-39-33(37)38)41-29(45)22-16-14-21(15-17-22)20-27-32(48)43(34(49)50-27)23-9-4-5-10-23/h14-17,20,23-26H,2-13,18-19,35H2,1H3,(H2,36,44)(H,40,46)(H,41,45)(H,42,47)(H4,37,38,39)/b27-20-/t24-,25-,26-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109145 (CHEMBL3601357) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(CCCC#C)C2=O)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C36H45N9O6S/c1-2-3-9-21-45-34(50)28(52-36(45)51)22-23-15-17-25(18-16-23)31(47)42-27(14-10-20-41-35(39)40)32(48)43-26(13-7-8-19-37)33(49)44-29(30(38)46)24-11-5-4-6-12-24/h1,4-6,11-12,15-18,22,26-27,29H,3,7-10,13-14,19-21,37H2,(H2,38,46)(H,42,47)(H,43,48)(H,44,49)(H4,39,40,41)/b28-22-/t26-,27-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026765 (CHEMBL3335494) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@H](C(N)=O)c1ccccc1 |r| Show InChI InChI=1S/C27H38N8O4/c28-16-8-7-14-20(26(39)35-22(23(29)36)18-10-3-1-4-11-18)34-25(38)21(15-9-17-32-27(30)31)33-24(37)19-12-5-2-6-13-19/h1-6,10-13,20-22H,7-9,14-17,28H2,(H2,29,36)(H,33,37)(H,34,38)(H,35,39)(H4,30,31,32)/t20-,21-,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109263 (CHEMBL3601100) Show SMILES CC(C)N1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C34H45N9O6S/c1-20(2)43-32(48)26(50-34(43)49)19-21-13-15-23(16-14-21)29(45)40-25(12-8-18-39-33(37)38)30(46)41-24(11-6-7-17-35)31(47)42-27(28(36)44)22-9-4-3-5-10-22/h3-5,9-10,13-16,19-20,24-25,27H,6-8,11-12,17-18,35H2,1-2H3,(H2,36,44)(H,40,45)(H,41,46)(H,42,47)(H4,37,38,39)/b26-19-/t24-,25-,27-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026808 (CHEMBL2440341) Show SMILES CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C(/C#N)C(=O)NC2CC2)cc1)C(N)=O |r| Show InChI InChI=1S/C32H48N10O5/c1-2-3-7-24(27(35)43)40-30(46)25(8-4-5-16-33)42-31(47)26(9-6-17-38-32(36)37)41-28(44)21-12-10-20(11-13-21)18-22(19-34)29(45)39-23-14-15-23/h10-13,18,23-26H,2-9,14-17,33H2,1H3,(H2,35,43)(H,39,45)(H,40,46)(H,41,44)(H,42,47)(H4,36,37,38)/b22-18+/t24-,25-,26-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (West Nile virus)	BDBM50109264 (CHEMBL3601101) Show SMILES CC(C)CN1C(=O)S\C(=C/c2ccc(cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(N)=O)c2ccccc2)C1=O |r| Show InChI InChI=1S/C35H47N9O6S/c1-21(2)20-44-33(49)27(51-35(44)50)19-22-13-15-24(16-14-22)30(46)41-26(12-8-18-40-34(38)39)31(47)42-25(11-6-7-17-36)32(48)43-28(29(37)45)23-9-4-3-5-10-23/h3-5,9-10,13-16,19,21,25-26,28H,6-8,11-12,17-18,20,36H2,1-2H3,(H2,37,45)(H,41,46)(H,42,47)(H,43,48)(H4,38,39,40)/b27-19-/t25-,26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of WNV NS2B-NS3 protease expressed in Escherichia coli BL21 lambda (DE3) cells using Abz-Gly-Leu-Lys-Arg-Gly-Gly-3-(NO2)Tyr as substrate p...				Bioorg Med Chem 23: 5748-55 (2015) Article DOI: 10.1016/j.bmc.2015.07.012 BindingDB Entry DOI: 10.7270/Q25B048V
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026789 (CHEMBL3335499) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C28H40N8O5/c29-15-5-4-9-21(27(41)36-23(24(30)38)17-18-11-13-20(37)14-12-18)35-26(40)22(10-6-16-33-28(31)32)34-25(39)19-7-2-1-3-8-19/h1-3,7-8,11-14,21-23,37H,4-6,9-10,15-17,29H2,(H2,30,38)(H,34,39)(H,35,40)(H,36,41)(H4,31,32,33)/t21-,22-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026802 (CHEMBL3335511) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](CC1CCCCC1)C(N)=O |r| Show InChI InChI=1S/C28H46N8O4/c29-16-8-7-14-21(27(40)36-23(24(30)37)18-19-10-3-1-4-11-19)35-26(39)22(15-9-17-33-28(31)32)34-25(38)20-12-5-2-6-13-20/h2,5-6,12-13,19,21-23H,1,3-4,7-11,14-18,29H2,(H2,30,37)(H,34,38)(H,35,39)(H,36,40)(H4,31,32,33)/t21-,22-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026813 (CHEMBL3335520) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCC3)C2=O)cc1)C(=O)N1Cc2ccccc2CC1C(N)=O |r| Show InChI InChI=1S/C38H49N9O6S/c39-18-6-5-12-29(35(51)46-22-26-9-2-1-8-25(26)21-30(46)32(40)48)45-34(50)28(13-7-19-43-37(41)42)44-33(49)24-16-14-23(15-17-24)20-31-36(52)47(38(53)54-31)27-10-3-4-11-27/h1-2,8-9,14-17,20,27-30H,3-7,10-13,18-19,21-22,39H2,(H2,40,48)(H,44,49)(H,45,50)(H4,41,42,43)/b31-20-/t28-,29-,30?/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026771 (CHEMBL3335488) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C28H40N8O4/c29-16-8-7-14-21(27(40)36-23(24(30)37)18-19-10-3-1-4-11-19)35-26(39)22(15-9-17-33-28(31)32)34-25(38)20-12-5-2-6-13-20/h1-6,10-13,21-23H,7-9,14-18,29H2,(H2,30,37)(H,34,38)(H,35,39)(H,36,40)(H4,31,32,33)/t21-,22-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026784 (CHEMBL2440339) Show SMILES CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C25H42N8O4/c1-2-3-12-18(21(27)34)31-23(36)19(13-7-8-15-26)33-24(37)20(14-9-16-30-25(28)29)32-22(35)17-10-5-4-6-11-17/h4-6,10-11,18-20H,2-3,7-9,12-16,26H2,1H3,(H2,27,34)(H,31,36)(H,32,35)(H,33,37)(H4,28,29,30)/t18-,19-,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026786 (CHEMBL3335496) Show SMILES CCCC[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C25H42N8O4/c1-2-3-12-18(21(27)34)31-23(36)19(13-7-8-15-26)33-24(37)20(14-9-16-30-25(28)29)32-22(35)17-10-5-4-6-11-17/h4-6,10-11,18-20H,2-3,7-9,12-16,26H2,1H3,(H2,27,34)(H,31,36)(H,32,35)(H,33,37)(H4,28,29,30)/t18-,19+,20+/m1/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026801 (CHEMBL3335510) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C#N)C(N)=O |r| Show InChI InChI=1S/C29H39N9O4/c30-15-5-4-9-22(28(42)38-24(25(32)39)17-19-11-13-20(18-31)14-12-19)37-27(41)23(10-6-16-35-29(33)34)36-26(40)21-7-2-1-3-8-21/h1-3,7-8,11-14,22-24H,4-6,9-10,15-17,30H2,(H2,32,39)(H,36,40)(H,37,41)(H,38,42)(H4,33,34,35)/t22-,23-,24-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026787 (CHEMBL3335497) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)Nc1ccccc1C(N)=O |r| Show InChI InChI=1S/C26H36N8O4/c27-15-7-6-13-20(24(37)32-19-12-5-4-11-18(19)22(28)35)34-25(38)21(14-8-16-31-26(29)30)33-23(36)17-9-2-1-3-10-17/h1-5,9-12,20-21H,6-8,13-16,27H2,(H2,28,35)(H,32,37)(H,33,36)(H,34,38)(H4,29,30,31)/t20-,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026803 (CHEMBL3335512) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)NC(C1CCCCC1)C(N)=O |r| Show InChI InChI=1S/C27H44N8O4/c28-16-8-7-14-20(26(39)35-22(23(29)36)18-10-3-1-4-11-18)34-25(38)21(15-9-17-32-27(30)31)33-24(37)19-12-5-2-6-13-19/h2,5-6,12-13,18,20-22H,1,3-4,7-11,14-17,28H2,(H2,29,36)(H,33,37)(H,34,38)(H,35,39)(H4,30,31,32)/t20-,21-,22?/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.74E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026795 (CHEMBL3335505) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)NC(CC#C)C(N)=O |r| Show InChI InChI=1S/C24H36N8O4/c1-2-9-17(20(26)33)30-22(35)18(12-6-7-14-25)32-23(36)19(13-8-15-29-24(27)28)31-21(34)16-10-4-3-5-11-16/h1,3-5,10-11,17-19H,6-9,12-15,25H2,(H2,26,33)(H,30,35)(H,31,34)(H,32,36)(H4,27,28,29)/t17?,18-,19-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026800 (CHEMBL3335509) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O |r| Show InChI InChI=1S/C28H39N9O6/c29-15-5-4-9-21(27(41)36-23(24(30)38)17-18-11-13-20(14-12-18)37(42)43)35-26(40)22(10-6-16-33-28(31)32)34-25(39)19-7-2-1-3-8-19/h1-3,7-8,11-14,21-23H,4-6,9-10,15-17,29H2,(H2,30,38)(H,34,39)(H,35,40)(H,36,41)(H4,31,32,33)/t21-,22-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026788 (CHEMBL3335498) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r| Show InChI InChI=1S/C30H41N9O4/c31-15-7-6-13-23(29(43)39-25(26(32)40)17-20-18-36-22-12-5-4-11-21(20)22)38-28(42)24(14-8-16-35-30(33)34)37-27(41)19-9-2-1-3-10-19/h1-5,9-12,18,23-25,36H,6-8,13-17,31H2,(H2,32,40)(H,37,41)(H,38,42)(H,39,43)(H4,33,34,35)/t23-,24-,25-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026769 (CHEMBL3335490) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C21H34N8O4/c22-11-5-4-9-15(19(32)27-13-17(23)30)29-20(33)16(10-6-12-26-21(24)25)28-18(31)14-7-2-1-3-8-14/h1-3,7-8,15-16H,4-6,9-13,22H2,(H2,23,30)(H,27,32)(H,28,31)(H,29,33)(H4,24,25,26)/t15-,16-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026804 (CHEMBL3335513) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C25H42N8O4/c1-16(2)15-20(21(27)34)33-24(37)18(11-6-7-13-26)32-23(36)19(12-8-14-30-25(28)29)31-22(35)17-9-4-3-5-10-17/h3-5,9-10,16,18-20H,6-8,11-15,26H2,1-2H3,(H2,27,34)(H,31,35)(H,32,36)(H,33,37)(H4,28,29,30)/t18-,19-,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026812 (CHEMBL3335519) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C(/C#N)C(=O)NC2CC2)cc1)C(=O)N1Cc2ccccc2CC1C(N)=O |r| Show InChI InChI=1S/C36H46N10O5/c37-16-4-3-8-29(35(51)46-21-25-7-2-1-6-24(25)19-30(46)31(39)47)45-34(50)28(9-5-17-42-36(40)41)44-32(48)23-12-10-22(11-13-23)18-26(20-38)33(49)43-27-14-15-27/h1-2,6-7,10-13,18,27-30H,3-5,8-9,14-17,19,21,37H2,(H2,39,47)(H,43,49)(H,44,48)(H,45,50)(H4,40,41,42)/b26-18+/t28-,29-,30?/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026767 (CHEMBL3335492) Show SMILES CCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C24H40N8O4/c1-2-9-17(20(26)33)30-22(35)18(12-6-7-14-25)32-23(36)19(13-8-15-29-24(27)28)31-21(34)16-10-4-3-5-11-16/h3-5,10-11,17-19H,2,6-9,12-15,25H2,1H3,(H2,26,33)(H,30,35)(H,31,34)(H,32,36)(H4,27,28,29)/t17-,18-,19-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026805 (CHEMBL3335514) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C25H42N8O4/c1-3-16(2)20(21(27)34)33-24(37)18(12-7-8-14-26)32-23(36)19(13-9-15-30-25(28)29)31-22(35)17-10-5-4-6-11-17/h4-6,10-11,16,18-20H,3,7-9,12-15,26H2,1-2H3,(H2,27,34)(H,31,35)(H,32,36)(H,33,37)(H4,28,29,30)/t16-,18-,19-,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026807 (CHEMBL3335516) Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C24H40N8O4/c1-15(2)19(20(26)33)32-23(36)17(11-6-7-13-25)31-22(35)18(12-8-14-29-24(27)28)30-21(34)16-9-4-3-5-10-16/h3-5,9-10,15,17-19H,6-8,11-14,25H2,1-2H3,(H2,26,33)(H,30,34)(H,31,35)(H,32,36)(H4,27,28,29)/t17-,18-,19-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026815 (CHEMBL3335522) Show SMILES CC(C)(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(\C=C2/SC(=O)N(C3CCCC3)C2=O)cc1)C(N)=O |r| Show InChI InChI=1S/C34H51N9O6S/c1-34(2,3)26(27(36)44)42-30(47)23(11-6-7-17-35)41-29(46)24(12-8-18-39-32(37)38)40-28(45)21-15-13-20(14-16-21)19-25-31(48)43(33(49)50-25)22-9-4-5-10-22/h13-16,19,22-24,26H,4-12,17-18,35H2,1-3H3,(H2,36,44)(H,40,45)(H,41,46)(H,42,47)(H4,37,38,39)/b25-19-/t23-,24-,26+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026797 (CHEMBL3335507) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1cccnc1)C(N)=O |r| Show InChI InChI=1S/C27H39N9O4/c28-13-5-4-11-20(26(40)36-22(23(29)37)16-18-8-6-14-32-17-18)35-25(39)21(12-7-15-33-27(30)31)34-24(38)19-9-2-1-3-10-19/h1-3,6,8-10,14,17,20-22H,4-5,7,11-13,15-16,28H2,(H2,29,37)(H,34,38)(H,35,39)(H,36,40)(H4,30,31,33)/t20-,21-,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026772 (CHEMBL3335487) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C22H36N8O5/c23-11-5-4-9-15(21(35)30-17(13-31)18(24)32)29-20(34)16(10-6-12-27-22(25)26)28-19(33)14-7-2-1-3-8-14/h1-3,7-8,15-17,31H,4-6,9-13,23H2,(H2,24,32)(H,28,33)(H,29,34)(H,30,35)(H4,25,26,27)/t15-,16-,17-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026770 (CHEMBL3335489) Show SMILES C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C22H36N8O4/c1-14(18(24)31)28-20(33)16(10-5-6-12-23)30-21(34)17(11-7-13-27-22(25)26)29-19(32)15-8-3-2-4-9-15/h2-4,8-9,14,16-17H,5-7,10-13,23H2,1H3,(H2,24,31)(H,28,33)(H,29,32)(H,30,34)(H4,25,26,27)/t14-,16-,17-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50026799 (CHEMBL3335508) Show SMILES NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccn1)C(N)=O |r| Show InChI InChI=1S/C27H39N9O4/c28-14-6-4-12-20(26(40)36-22(23(29)37)17-19-11-5-7-15-32-19)35-25(39)21(13-8-16-33-27(30)31)34-24(38)18-9-2-1-3-10-18/h1-3,5,7,9-11,15,20-22H,4,6,8,12-14,16-17,28H2,(H2,29,37)(H,34,38)(H,35,39)(H,36,40)(H4,30,31,33)/t20-,21-,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Dengue virus serotype 2 NS2B-NS3 protease by homogeneous fluorimetric assay				ACS Med Chem Lett 5: 1037-42 (2014) Article DOI: 10.1021/ml500245v BindingDB Entry DOI: 10.7270/Q2028T42
					More data for this Ligand-Target Pair

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