Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50004793   

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
Integrase (Human immunodeficiency virus 1)	BDBM50485906 (CHEMBL2180587) Show SMILES Oc1c(nc(NCCCCCCNC=O)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C23H26FN5O3/c24-17-9-7-16(8-10-17)14-28-23(32)20-21(31)19-18(6-5-13-26-19)22(29-20)27-12-4-2-1-3-11-25-15-30/h5-10,13,15,31H,1-4,11-12,14H2,(H,25,30)(H,27,29)(H,28,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485904 (CHEMBL2180591) Show SMILES C[C@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r| Show InChI InChI=1S/C19H19FN4O3/c1-11(10-25)23-18-14-3-2-8-21-15(14)17(26)16(24-18)19(27)22-9-12-4-6-13(20)7-5-12/h2-8,11,25-26H,9-10H2,1H3,(H,22,27)(H,23,24)/t11-/m1/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485905 (CHEMBL2180589) Show SMILES OCCNc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 Show InChI InChI=1S/C18H17FN4O3/c19-12-5-3-11(4-6-12)10-22-18(26)15-16(25)14-13(2-1-7-20-14)17(23-15)21-8-9-24/h1-7,24-25H,8-10H2,(H,21,23)(H,22,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485914 (CHEMBL2180590) Show SMILES C[C@@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r| Show InChI InChI=1S/C19H19FN4O3/c1-11(10-25)23-18-14-3-2-8-21-15(14)17(26)16(24-18)19(27)22-9-12-4-6-13(20)7-5-12/h2-8,11,25-26H,9-10H2,1H3,(H,22,27)(H,23,24)/t11-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50021581 (CHEMBL414850 | L-870810) Show SMILES O\C(=N/Cc1ccc(F)cc1)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O Show InChI InChI=1S/C20H19FN4O4S/c21-14-7-5-13(6-8-14)12-23-20(27)17-18(26)16-15(4-3-9-22-16)19(24-17)25-10-1-2-11-30(25,28)29/h3-9,26H,1-2,10-12H2,(H,23,27)	PDB 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
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485907 (CHEMBL2180599) Show SMILES Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C16H11BrFN3O2/c17-15-11-2-1-7-19-12(11)14(22)13(21-15)16(23)20-8-9-3-5-10(18)6-4-9/h1-7,22H,8H2,(H,20,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485917 (CHEMBL2180585) Show SMILES CS(=O)(=O)NCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C21H24FN5O6S2/c1-34(30,31)25-11-4-12-27(35(2,32)33)20-16-5-3-10-23-17(16)19(28)18(26-20)21(29)24-13-14-6-8-15(22)9-7-14/h3,5-10,25,28H,4,11-13H2,1-2H3,(H,24,29)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485913 (CHEMBL2180586) Show SMILES CS(=O)(=O)NCCCCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C24H30FN5O6S2/c1-37(33,34)28-14-5-3-4-6-15-30(38(2,35)36)23-19-8-7-13-26-20(19)22(31)21(29-23)24(32)27-16-17-9-11-18(25)12-10-17/h7-13,28,31H,3-6,14-16H2,1-2H3,(H,27,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485911 (CHEMBL2180588) Show SMILES Oc1c(nc(NCCc2c[nH]c3ccccc23)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C26H22FN5O2/c27-18-9-7-16(8-10-18)14-31-26(34)23-24(33)22-20(5-3-12-28-22)25(32-23)29-13-11-17-15-30-21-6-2-1-4-19(17)21/h1-10,12,15,30,33H,11,13-14H2,(H,29,32)(H,31,34)	PDB 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
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485906 (CHEMBL2180587) Show SMILES Oc1c(nc(NCCCCCCNC=O)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C23H26FN5O3/c24-17-9-7-16(8-10-17)14-28-23(32)20-21(31)19-18(6-5-13-26-19)22(29-20)27-12-4-2-1-3-11-25-15-30/h5-10,13,15,31H,1-4,11-12,14H2,(H,25,30)(H,27,29)(H,28,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485904 (CHEMBL2180591) Show SMILES C[C@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r| Show InChI InChI=1S/C19H19FN4O3/c1-11(10-25)23-18-14-3-2-8-21-15(14)17(26)16(24-18)19(27)22-9-12-4-6-13(20)7-5-12/h2-8,11,25-26H,9-10H2,1H3,(H,22,27)(H,23,24)/t11-/m1/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485914 (CHEMBL2180590) Show SMILES C[C@@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r| Show InChI InChI=1S/C19H19FN4O3/c1-11(10-25)23-18-14-3-2-8-21-15(14)17(26)16(24-18)19(27)22-9-12-4-6-13(20)7-5-12/h2-8,11,25-26H,9-10H2,1H3,(H,22,27)(H,23,24)/t11-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485905 (CHEMBL2180589) Show SMILES OCCNc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 Show InChI InChI=1S/C18H17FN4O3/c19-12-5-3-11(4-6-12)10-22-18(26)15-16(25)14-13(2-1-7-20-14)17(23-15)21-8-9-24/h1-7,24-25H,8-10H2,(H,21,23)(H,22,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485913 (CHEMBL2180586) Show SMILES CS(=O)(=O)NCCCCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C24H30FN5O6S2/c1-37(33,34)28-14-5-3-4-6-15-30(38(2,35)36)23-19-8-7-13-26-20(19)22(31)21(29-23)24(32)27-16-17-9-11-18(25)12-10-17/h7-13,28,31H,3-6,14-16H2,1-2H3,(H,27,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50021581 (CHEMBL414850 | L-870810) Show SMILES O\C(=N/Cc1ccc(F)cc1)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O Show InChI InChI=1S/C20H19FN4O4S/c21-14-7-5-13(6-8-14)12-23-20(27)17-18(26)16-15(4-3-9-22-16)19(24-17)25-10-1-2-11-30(25,28)29/h3-9,26H,1-2,10-12H2,(H,23,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485912 (CHEMBL2180600) Show SMILES CS(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C17H13BrFN3O4S/c1-27(24,25)26-15-13-12(3-2-8-20-13)16(18)22-14(15)17(23)21-9-10-4-6-11(19)7-5-10/h2-8H,9H2,1H3,(H,21,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485907 (CHEMBL2180599) Show SMILES Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C16H11BrFN3O2/c17-15-11-2-1-7-19-12(11)14(22)13(21-15)16(23)20-8-9-3-5-10(18)6-4-9/h1-7,22H,8H2,(H,20,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485911 (CHEMBL2180588) Show SMILES Oc1c(nc(NCCc2c[nH]c3ccccc23)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C26H22FN5O2/c27-18-9-7-16(8-10-18)14-31-26(34)23-24(33)22-20(5-3-12-28-22)25(32-23)29-13-11-17-15-30-21-6-2-1-4-19(17)21/h1-10,12,15,30,33H,11,13-14H2,(H,29,32)(H,31,34)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485915 (CHEMBL2180601) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C23H17BrFN3O4S/c1-14-4-10-17(11-5-14)33(30,31)32-21-19-18(3-2-12-26-19)22(24)28-20(21)23(29)27-13-15-6-8-16(25)9-7-15/h2-12H,13H2,1H3,(H,27,29)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485917 (CHEMBL2180585) Show SMILES CS(=O)(=O)NCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C21H24FN5O6S2/c1-34(30,31)25-11-4-12-27(35(2,32)33)20-16-5-3-10-23-17(16)19(28)18(26-20)21(29)24-13-14-6-8-15(22)9-7-14/h3,5-10,25,28H,4,11-13H2,1-2H3,(H,24,29)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485910 (CHEMBL2180593) Show SMILES OCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C18H16BrFN4O2/c19-17-13-2-1-7-21-14(13)15(22-8-9-25)16(24-17)18(26)23-10-11-3-5-12(20)6-4-11/h1-7,22,25H,8-10H2,(H,23,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485908 (CHEMBL2180598) Show SMILES NCCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C19H19BrFN5O/c20-18-14-3-1-9-23-15(14)16(24-10-2-8-22)17(26-18)19(27)25-11-12-4-6-13(21)7-5-12/h1,3-7,9,24H,2,8,10-11,22H2,(H,25,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485903 (CHEMBL2180592) Show SMILES CNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C17H14BrFN4O/c1-20-14-13-12(3-2-8-21-13)16(18)23-15(14)17(24)22-9-10-4-6-11(19)7-5-10/h2-8,20H,9H2,1H3,(H,22,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485902 (CHEMBL2180594) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccccc2)cc1 Show InChI InChI=1S/C23H18BrFN4O/c24-22-18-7-4-12-26-19(18)20(27-13-15-5-2-1-3-6-15)21(29-22)23(30)28-14-16-8-10-17(25)11-9-16/h1-12,27H,13-14H2,(H,28,30)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485909 (CHEMBL2180597) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C23H17BrF2N4O/c24-22-18-2-1-11-27-19(18)20(28-12-14-3-7-16(25)8-4-14)21(30-22)23(31)29-13-15-5-9-17(26)10-6-15/h1-11,28H,12-13H2,(H,29,31)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485903 (CHEMBL2180592) Show SMILES CNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C17H14BrFN4O/c1-20-14-13-12(3-2-8-21-13)16(18)23-15(14)17(24)22-9-10-4-6-11(19)7-5-10/h2-8,20H,9H2,1H3,(H,22,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485910 (CHEMBL2180593) Show SMILES OCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C18H16BrFN4O2/c19-17-13-2-1-7-21-14(13)15(22-8-9-25)16(24-17)18(26)23-10-11-3-5-12(20)6-4-11/h1-7,22,25H,8-10H2,(H,23,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485902 (CHEMBL2180594) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccccc2)cc1 Show InChI InChI=1S/C23H18BrFN4O/c24-22-18-7-4-12-26-19(18)20(27-13-15-5-2-1-3-6-15)21(29-22)23(30)28-14-16-8-10-17(25)11-9-16/h1-12,27H,13-14H2,(H,28,30)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485899 (CHEMBL2180572) Show SMILES NCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C18H17BrFN5O/c19-17-13-2-1-8-22-14(13)15(23-9-7-21)16(25-17)18(26)24-10-11-3-5-12(20)6-4-11/h1-6,8,23H,7,9-10,21H2,(H,24,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485908 (CHEMBL2180598) Show SMILES NCCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C19H19BrFN5O/c20-18-14-3-1-9-23-15(14)16(24-10-2-8-22)17(26-18)19(27)25-11-12-4-6-13(21)7-5-12/h1,3-7,9,24H,2,8,10-11,22H2,(H,25,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485909 (CHEMBL2180597) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C23H17BrF2N4O/c24-22-18-2-1-11-27-19(18)20(28-12-14-3-7-16(25)8-4-14)21(30-22)23(31)29-13-15-5-9-17(26)10-6-15/h1-11,28H,12-13H2,(H,29,31)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485900 (CHEMBL2180571) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCCCNc2c(nc(Br)c3cccnc23)C(=O)NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C35H28Br2F2N8O2/c36-32-24-4-1-14-40-26(24)28(30(46-32)34(48)44-18-20-6-10-22(38)11-7-20)42-16-3-17-43-29-27-25(5-2-15-41-27)33(37)47-31(29)35(49)45-19-21-8-12-23(39)13-9-21/h1-2,4-15,42-43H,3,16-19H2,(H,44,48)(H,45,49)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485899 (CHEMBL2180572) Show SMILES NCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C18H17BrFN5O/c19-17-13-2-1-8-22-14(13)15(23-9-7-21)16(25-17)18(26)24-10-11-3-5-12(20)6-4-11/h1-6,8,23H,7,9-10,21H2,(H,24,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485900 (CHEMBL2180571) Show SMILES Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCCCNc2c(nc(Br)c3cccnc23)C(=O)NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C35H28Br2F2N8O2/c36-32-24-4-1-14-40-26(24)28(30(46-32)34(48)44-18-20-6-10-22(38)11-7-20)42-16-3-17-43-29-27-25(5-2-15-41-27)33(37)47-31(29)35(49)45-19-21-8-12-23(39)13-9-21/h1-2,4-15,42-43H,3,16-19H2,(H,44,48)(H,45,49)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485901 (CHEMBL2180595) Show SMILES C[C@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r| Show InChI InChI=1S/C24H20BrFN4O/c1-15(17-6-3-2-4-7-17)29-21-20-19(8-5-13-27-20)23(25)30-22(21)24(31)28-14-16-9-11-18(26)12-10-16/h2-13,15,29H,14H2,1H3,(H,28,31)/t15-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485915 (CHEMBL2180601) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C23H17BrFN3O4S/c1-14-4-10-17(11-5-14)33(30,31)32-21-19-18(3-2-12-26-19)22(24)28-20(21)23(29)27-13-15-6-8-16(25)9-7-15/h2-12H,13H2,1H3,(H,27,29)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485916 (CHEMBL2180596) Show SMILES C[C@@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r| Show InChI InChI=1S/C24H20BrFN4O/c1-15(17-6-3-2-4-7-17)29-21-20-19(8-5-13-27-20)23(25)30-22(21)24(31)28-14-16-9-11-18(26)12-10-16/h2-13,15,29H,14H2,1H3,(H,28,31)/t15-/m1/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485916 (CHEMBL2180596) Show SMILES C[C@@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r| Show InChI InChI=1S/C24H20BrFN4O/c1-15(17-6-3-2-4-7-17)29-21-20-19(8-5-13-27-20)23(25)30-22(21)24(31)28-14-16-9-11-18(26)12-10-16/h2-13,15,29H,14H2,1H3,(H,28,31)/t15-/m1/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485912 (CHEMBL2180600) Show SMILES CS(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C17H13BrFN3O4S/c1-27(24,25)26-15-13-12(3-2-8-20-13)16(18)22-14(15)17(23)21-9-10-4-6-11(19)7-5-10/h2-8H,9H2,1H3,(H,21,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485901 (CHEMBL2180595) Show SMILES C[C@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r| Show InChI InChI=1S/C24H20BrFN4O/c1-15(17-6-3-2-4-7-17)29-21-20-19(8-5-13-27-20)23(25)30-22(21)24(31)28-14-16-9-11-18(26)12-10-16/h2-13,15,29H,14H2,1H3,(H,28,31)/t15-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair