Compile Data Set for Download or QSAR

Found 268 hits with Last Name = 'zawahir' and Initial = 'z'   

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)	BDBM50477985 (CHEMBL412149) Show SMILES COc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OC |c:8| Show InChI InChI=1S/C14H13ClN6O3/c1-7-9(13(22)21(18-7)14-16-19-20-17-14)4-8-5-10(15)12(24-3)11(6-8)23-2/h4-6H,1-3H3,(H,16,17,19,20)/b9-4-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477992 (CHEMBL429327) Show SMILES CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OCC |c:9| Show InChI InChI=1S/C16H17ClN6O3/c1-4-25-13-8-10(7-12(17)14(13)26-5-2)6-11-9(3)20-23(15(11)24)16-18-21-22-19-16/h6-8H,4-5H2,1-3H3,(H,18,19,21,22)/b11-6-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477995 (CHEMBL407352) Show SMILES OC(=O)CSc1nnc(-c2ccco2)c(n1)-c1ccco1 Show InChI InChI=1S/C13H9N3O4S/c17-10(18)7-21-13-14-11(8-3-1-5-19-8)12(15-16-13)9-4-2-6-20-9/h1-6H,7H2,(H,17,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477985 (CHEMBL412149) Show SMILES COc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OC |c:8| Show InChI InChI=1S/C14H13ClN6O3/c1-7-9(13(22)21(18-7)14-16-19-20-17-14)4-8-5-10(15)12(24-3)11(6-8)23-2/h4-6H,1-3H3,(H,16,17,19,20)/b9-4-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477998 (CHEMBL272420) Show SMILES COc1ccc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc1OCc1ccccc1Cl |c:9| Show InChI InChI=1S/C20H17ClN6O3/c1-12-15(19(28)27(24-12)20-22-25-26-23-20)9-13-7-8-17(29-2)18(10-13)30-11-14-5-3-4-6-16(14)21/h3-10H,11H2,1-2H3,(H,22,23,25,26)/b15-9-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477993 (CHEMBL406595) Show SMILES Nc1c(sc2[nH]c(=O)c(cc12)C(O)=O)C(=O)Nc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C15H9Cl2N3O4S/c16-8-2-1-5(3-9(8)17)19-13(22)11-10(18)6-4-7(15(23)24)12(21)20-14(6)25-11/h1-4H,18H2,(H,19,22)(H,20,21)(H,23,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477992 (CHEMBL429327) Show SMILES CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OCC |c:9| Show InChI InChI=1S/C16H17ClN6O3/c1-4-25-13-8-10(7-12(17)14(13)26-5-2)6-11-9(3)20-23(15(11)24)16-18-21-22-19-16/h6-8H,4-5H2,1-3H3,(H,18,19,21,22)/b11-6-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50478002 (CHEMBL408699) Show SMILES COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@@H](CO)C(C)C Show InChI InChI=1S/C23H23ClFNO5/c1-12(2)19(11-27)26-10-16(23(29)30)22(28)15-8-14(20(31-3)9-18(15)26)7-13-5-4-6-17(24)21(13)25/h4-6,8-10,12,19,27H,7,11H2,1-3H3,(H,29,30)/t19-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.20	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477997 (CHEMBL273128) Show SMILES CC(C)[C@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 Show InChI InChI=1S/C22H21ClFNO4/c1-12(2)19(11-26)25-10-16(22(28)29)21(27)15-9-13(6-7-18(15)25)8-14-4-3-5-17(23)20(14)24/h3-7,9-10,12,19,26H,8,11H2,1-2H3,(H,28,29)/t19-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50183274 (6-(3-Chloro-2-fluorobenzyl)-1-(2-hydroxyethyl)-7-m...) Show SMILES COc1cc2n(CCO)cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F Show InChI InChI=1S/C20H17ClFNO5/c1-28-17-9-16-13(19(25)14(20(26)27)10-23(16)5-6-24)8-12(17)7-11-3-2-4-15(21)18(11)22/h2-4,8-10,24H,5-7H2,1H3,(H,26,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477983 (CHEMBL272194) Show SMILES CC1=NN(C(=O)\C1=C/c1cc(Cl)c(O)c(Cl)c1)c1nnn[nH]1 |t:1| Show InChI InChI=1S/C12H8Cl2N6O2/c1-5-7(2-6-3-8(13)10(21)9(14)4-6)11(22)20(17-5)12-15-18-19-16-12/h2-4,21H,1H3,(H,15,16,18,19)/b7-2-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477983 (CHEMBL272194) Show SMILES CC1=NN(C(=O)\C1=C/c1cc(Cl)c(O)c(Cl)c1)c1nnn[nH]1 |t:1| Show InChI InChI=1S/C12H8Cl2N6O2/c1-5-7(2-6-3-8(13)10(21)9(14)4-6)11(22)20(17-5)12-15-18-19-16-12/h2-4,21H,1H3,(H,15,16,18,19)/b7-2-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477993 (CHEMBL406595) Show SMILES Nc1c(sc2[nH]c(=O)c(cc12)C(O)=O)C(=O)Nc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C15H9Cl2N3O4S/c16-8-2-1-5(3-9(8)17)19-13(22)11-10(18)6-4-7(15(23)24)12(21)20-14(6)25-11/h1-4H,18H2,(H,19,22)(H,20,21)(H,23,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477998 (CHEMBL272420) Show SMILES COc1ccc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc1OCc1ccccc1Cl |c:9| Show InChI InChI=1S/C20H17ClN6O3/c1-12-15(19(28)27(24-12)20-22-25-26-23-20)9-13-7-8-17(29-2)18(10-13)30-11-14-5-3-4-6-16(14)21/h3-10H,11H2,1-2H3,(H,22,23,25,26)/b15-9-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50443463 (CHEMBL406596) Show SMILES Cc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)C(O)=O Show InChI InChI=1S/C17H14N2O3S2/c1-10-6-7-11(16(21)22)8-13(10)18-15(20)9-23-17-19-12-4-2-3-5-14(12)24-17/h2-8H,9H2,1H3,(H,18,20)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477995 (CHEMBL407352) Show SMILES OC(=O)CSc1nnc(-c2ccco2)c(n1)-c1ccco1 Show InChI InChI=1S/C13H9N3O4S/c17-10(18)7-21-13-14-11(8-3-1-5-19-8)12(15-16-13)9-4-2-6-20-9/h1-6H,7H2,(H,17,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50478000 (CHEMBL261833) Show SMILES OC(=O)c1ccccc1NC(=O)c1ccccc1S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H20N2O6S/c29-25(27-23-12-6-4-10-21(23)26(30)31)22-11-5-7-13-24(22)35(32,33)28-18-14-16-20(17-15-18)34-19-8-2-1-3-9-19/h1-17,28H,(H,27,29)(H,30,31)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477986 (CHEMBL272642) Show SMILES Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)\C=C\C(O)=O)cc1 Show InChI InChI=1S/C18H14N2O3S/c1-11-2-7-14-15(10-11)24-18(20-14)12-3-5-13(6-4-12)19-16(21)8-9-17(22)23/h2-10H,1H3,(H,19,21)(H,22,23)/b9-8+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50183276 (6-(3-chloro-2-fluorobenzyl)-1-(2-hydroxyethyl)-4-o...) Show SMILES OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 Show InChI InChI=1S/C19H15ClFNO4/c20-15-3-1-2-12(17(15)21)8-11-4-5-16-13(9-11)18(24)14(19(25)26)10-22(16)6-7-23/h1-5,9-10,23H,6-8H2,(H,25,26)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477989 (CHEMBL272448) Show SMILES OC(=O)C1CCCCC1C(=O)Nc1ccc(Oc2cccc3ccccc23)cc1 Show InChI InChI=1S/C24H23NO4/c26-23(20-9-3-4-10-21(20)24(27)28)25-17-12-14-18(15-13-17)29-22-11-5-7-16-6-1-2-8-19(16)22/h1-2,5-8,11-15,20-21H,3-4,9-10H2,(H,25,26)(H,27,28)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50478000 (CHEMBL261833) Show SMILES OC(=O)c1ccccc1NC(=O)c1ccccc1S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H20N2O6S/c29-25(27-23-12-6-4-10-21(23)26(30)31)22-11-5-7-13-24(22)35(32,33)28-18-14-16-20(17-15-18)34-19-8-2-1-3-9-19/h1-17,28H,(H,27,29)(H,30,31)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477999 (CHEMBL260960) Show SMILES COc1cccc(NC(=O)c2sc3[nH]c(=O)c(cc3c2N)C(O)=O)c1 Show InChI InChI=1S/C16H13N3O5S/c1-24-8-4-2-3-7(5-8)18-14(21)12-11(17)9-6-10(16(22)23)13(20)19-15(9)25-12/h2-6H,17H2,1H3,(H,18,21)(H,19,20)(H,22,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50235312 (6-(3-chloro-2-fluorobenzyl)-4-oxo-1,4-dihydroquino...) Show SMILES OC(=O)c1cnc2ccc(Cc3cccc(Cl)c3F)cc2c1O Show InChI InChI=1S/C17H11ClFNO3/c18-13-3-1-2-10(15(13)19)6-9-4-5-14-11(7-9)16(21)12(8-20-14)17(22)23/h1-5,7-8H,6H2,(H,20,21)(H,22,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477994 (CHEMBL272419) Show SMILES OC(C(O)c1nc2cc3ccccc3cc2[nH]1)C(O)=O Show InChI InChI=1S/C14H12N2O4/c17-11(12(18)14(19)20)13-15-9-5-7-3-1-2-4-8(7)6-10(9)16-13/h1-6,11-12,17-18H,(H,15,16)(H,19,20)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477986 (CHEMBL272642) Show SMILES Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)\C=C\C(O)=O)cc1 Show InChI InChI=1S/C18H14N2O3S/c1-11-2-7-14-15(10-11)24-18(20-14)12-3-5-13(6-4-12)19-16(21)8-9-17(22)23/h2-10H,1H3,(H,19,21)(H,22,23)/b9-8+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50478001 (CHEMBL272418) Show SMILES CCOc1cc(CNc2nn[nH]n2)cc(Cl)c1OCc1ccc(Cl)cc1 Show InChI InChI=1S/C17H17Cl2N5O2/c1-2-25-15-8-12(9-20-17-21-23-24-22-17)7-14(19)16(15)26-10-11-3-5-13(18)6-4-11/h3-8H,2,9-10H2,1H3,(H2,20,21,22,23,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477984 (CHEMBL260096) Show SMILES CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)ccc1OC |c:9| Show InChI InChI=1S/C15H16N6O3/c1-4-24-13-8-10(5-6-12(13)23-3)7-11-9(2)18-21(14(11)22)15-16-19-20-17-15/h5-8H,4H2,1-3H3,(H,16,17,19,20)/b11-7-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477991 (CHEMBL405927) Show SMILES OC(=O)CSc1nc(cc(-c2ccc(Cl)cc2)c1C#N)-c1ccccc1 Show InChI InChI=1S/C20H13ClN2O2S/c21-15-8-6-13(7-9-15)16-10-18(14-4-2-1-3-5-14)23-20(17(16)11-22)26-12-19(24)25/h1-10H,12H2,(H,24,25)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477996 (CHEMBL272193) Show SMILES CCOc1cc(ccc1\C=C1\C(C)=NN(C1=O)c1nnn[nH]1)N(CC)CC |c:13| Show InChI InChI=1S/C18H23N7O2/c1-5-24(6-2)14-9-8-13(16(11-14)27-7-3)10-15-12(4)21-25(17(15)26)18-19-22-23-20-18/h8-11H,5-7H2,1-4H3,(H,19,20,22,23)/b15-10-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50443463 (CHEMBL406596) Show SMILES Cc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)C(O)=O Show InChI InChI=1S/C17H14N2O3S2/c1-10-6-7-11(16(21)22)8-13(10)18-15(20)9-23-17-19-12-4-2-3-5-14(12)24-17/h2-8H,9H2,1H3,(H,18,20)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477996 (CHEMBL272193) Show SMILES CCOc1cc(ccc1\C=C1\C(C)=NN(C1=O)c1nnn[nH]1)N(CC)CC |c:13| Show InChI InChI=1S/C18H23N7O2/c1-5-24(6-2)14-9-8-13(16(11-14)27-7-3)10-15-12(4)21-25(17(15)26)18-19-22-23-20-18/h8-11H,5-7H2,1-4H3,(H,19,20,22,23)/b15-10-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM26602 (2-{5-[(3Z)-1-(carboxymethyl)-2-oxo-2,3-dihydro-1H-...) Show SMILES OC(=O)CN1C(=O)\C(=C2/SC(=S)N(C(Cc3ccccc3)C(O)=O)C2=O)c2ccccc12 Show InChI InChI=1S/C22H16N2O6S2/c25-16(26)11-23-14-9-5-4-8-13(14)17(19(23)27)18-20(28)24(22(31)32-18)15(21(29)30)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,25,26)(H,29,30)/b18-17-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477984 (CHEMBL260096) Show SMILES CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)ccc1OC |c:9| Show InChI InChI=1S/C15H16N6O3/c1-4-24-13-8-10(5-6-12(13)23-3)7-11-9(2)18-21(14(11)22)15-16-19-20-17-15/h5-8H,4H2,1-3H3,(H,16,17,19,20)/b11-7-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477999 (CHEMBL260960) Show SMILES COc1cccc(NC(=O)c2sc3[nH]c(=O)c(cc3c2N)C(O)=O)c1 Show InChI InChI=1S/C16H13N3O5S/c1-24-8-4-2-3-7(5-8)18-14(21)12-11(17)9-6-10(16(22)23)13(20)19-15(9)25-12/h2-6H,17H2,1H3,(H,18,21)(H,19,20)(H,22,23)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM26602 (2-{5-[(3Z)-1-(carboxymethyl)-2-oxo-2,3-dihydro-1H-...) Show SMILES OC(=O)CN1C(=O)\C(=C2/SC(=S)N(C(Cc3ccccc3)C(O)=O)C2=O)c2ccccc12 Show InChI InChI=1S/C22H16N2O6S2/c25-16(26)11-23-14-9-5-4-8-13(14)17(19(23)27)18-20(28)24(22(31)32-18)15(21(29)30)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,25,26)(H,29,30)/b18-17-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	92	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477991 (CHEMBL405927) Show SMILES OC(=O)CSc1nc(cc(-c2ccc(Cl)cc2)c1C#N)-c1ccccc1 Show InChI InChI=1S/C20H13ClN2O2S/c21-15-8-6-13(7-9-15)16-10-18(14-4-2-1-3-5-14)23-20(17(16)11-22)26-12-19(24)25/h1-10H,12H2,(H,24,25)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477987 (CHEMBL272204) Show SMILES OC(=O)CSc1nc(Nc2ccccc2)nc(n1)N1CCOCC1 Show InChI InChI=1S/C15H17N5O3S/c21-12(22)10-24-15-18-13(16-11-4-2-1-3-5-11)17-14(19-15)20-6-8-23-9-7-20/h1-5H,6-10H2,(H,21,22)(H,16,17,18,19)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477988 (CHEMBL258814) Show SMILES OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1ccccc1 Show InChI InChI=1S/C13H9F3N2O2S/c14-13(15,16)10-6-9(8-4-2-1-3-5-8)17-12(18-10)21-7-11(19)20/h1-6H,7H2,(H,19,20)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477988 (CHEMBL258814) Show SMILES OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1ccccc1 Show InChI InChI=1S/C13H9F3N2O2S/c14-13(15,16)10-6-9(8-4-2-1-3-5-8)17-12(18-10)21-7-11(19)20/h1-6H,7H2,(H,19,20)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477989 (CHEMBL272448) Show SMILES OC(=O)C1CCCCC1C(=O)Nc1ccc(Oc2cccc3ccccc23)cc1 Show InChI InChI=1S/C24H23NO4/c26-23(20-9-3-4-10-21(20)24(27)28)25-17-12-14-18(15-13-17)29-22-11-5-7-16-6-1-2-8-19(16)22/h1-2,5-8,11-15,20-21H,3-4,9-10H2,(H,25,26)(H,27,28)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477990 (CHEMBL258815) Show SMILES OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1cccs1 Show InChI InChI=1S/C11H7F3N2O2S2/c12-11(13,14)8-4-6(7-2-1-3-19-7)15-10(16-8)20-5-9(17)18/h1-4H,5H2,(H,17,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477990 (CHEMBL258815) Show SMILES OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1cccs1 Show InChI InChI=1S/C11H7F3N2O2S2/c12-11(13,14)8-4-6(7-2-1-3-19-7)15-10(16-8)20-5-9(17)18/h1-4H,5H2,(H,17,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477994 (CHEMBL272419) Show SMILES OC(C(O)c1nc2cc3ccccc3cc2[nH]1)C(O)=O Show InChI InChI=1S/C14H12N2O4/c17-11(12(18)14(19)20)13-15-9-5-7-3-1-2-4-8(7)6-10(9)16-13/h1-6,11-12,17-18H,(H,15,16)(H,19,20)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50477987 (CHEMBL272204) Show SMILES OC(=O)CSc1nc(Nc2ccccc2)nc(n1)N1CCOCC1 Show InChI InChI=1S/C15H17N5O3S/c21-12(22)10-24-15-18-13(16-11-4-2-1-3-5-11)17-14(19-15)20-6-8-23-9-7-20/h1-5H,6-10H2,(H,21,22)(H,16,17,18,19)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50478001 (CHEMBL272418) Show SMILES CCOc1cc(CNc2nn[nH]n2)cc(Cl)c1OCc1ccc(Cl)cc1 Show InChI InChI=1S/C17H17Cl2N5O2/c1-2-25-15-8-12(9-20-17-21-23-24-22-17)7-14(19)16(15)26-10-11-3-5-13(18)6-4-11/h3-8H,2,9-10H2,1H3,(H2,20,21,22,23,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-end processing activity				J Med Chem 51: 1136-44 (2008) Article DOI: 10.1021/jm070609b BindingDB Entry DOI: 10.7270/Q25Q4ZVQ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50192261 (CHEMBL265159 | KQLTEAVQKITTESIVIWGK) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(O)=O Show InChI InChI=1S/C103H174N26O31/c1-17-52(10)79(97(153)120-70(45-59-46-110-62-30-21-20-28-60(59)62)87(143)111-47-74(136)113-68(103(159)160)32-24-27-43-106)126-96(152)78(51(8)9)123-98(154)80(53(11)18-2)125-94(150)71(48-130)121-91(147)67(36-40-76(139)140)118-101(157)83(57(15)132)129-102(158)84(58(16)133)128-99(155)81(54(12)19-3)124-92(148)63(31-23-26-42-105)115-89(145)65(34-38-73(109)135)116-95(151)77(50(6)7)122-85(141)55(13)112-88(144)66(35-39-75(137)138)117-100(156)82(56(14)131)127-93(149)69(44-49(4)5)119-90(146)64(33-37-72(108)134)114-86(142)61(107)29-22-25-41-104/h20-21,28,30,46,49-58,61,63-71,77-84,110,130-133H,17-19,22-27,29,31-45,47-48,104-107H2,1-16H3,(H2,108,134)(H2,109,135)(H,111,143)(H,112,144)(H,113,136)(H,114,142)(H,115,145)(H,116,151)(H,117,156)(H,118,157)(H,119,146)(H,120,153)(H,121,147)(H,122,141)(H,123,154)(H,124,148)(H,125,150)(H,126,152)(H,127,149)(H,128,155)(H,129,158)(H,137,138)(H,139,140)(H,159,160)/t52-,53-,54-,55-,56+,57+,58+,61-,63-,64-,65-,66-,67-,68-,69-,70-,71-,77-,78-,79-,80-,81-,82-,83-,84-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase C130S mutant strand transfer step				Bioorg Med Chem Lett 16: 5199-202 (2006) Article DOI: 10.1016/j.bmcl.2006.07.022 BindingDB Entry DOI: 10.7270/Q20G3JSH
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50192264 (CHEMBL412522 | ETWETWWTEYWQATWIPEWE) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(O)=O Show InChI InChI=1S/C135H165N27O37/c1-8-65(2)111(134(197)162-51-21-34-104(162)129(192)147-93(41-47-107(171)172)119(182)151-99(54-73-60-139-87-29-16-10-23-80(73)87)125(188)149-96(135(198)199)44-50-110(177)178)157-127(190)103(58-77-64-143-91-33-20-14-27-84(77)91)156-131(194)112(67(4)163)158-116(179)66(3)144-118(181)92(40-45-105(137)168)145-123(186)98(53-72-59-138-86-28-15-9-22-79(72)86)152-122(185)97(52-71-35-37-78(167)38-36-71)150-120(183)94(42-48-108(173)174)148-130(193)114(69(6)165)161-128(191)102(57-76-63-142-90-32-19-13-26-83(76)90)153-126(189)101(56-75-62-141-89-31-18-12-25-82(75)89)155-133(196)115(70(7)166)160-121(184)95(43-49-109(175)176)146-124(187)100(55-74-61-140-88-30-17-11-24-81(74)88)154-132(195)113(68(5)164)159-117(180)85(136)39-46-106(169)170/h9-20,22-33,35-38,59-70,85,92-104,111-115,138-143,163-167H,8,21,34,39-58,136H2,1-7H3,(H2,137,168)(H,144,181)(H,145,186)(H,146,187)(H,147,192)(H,148,193)(H,149,188)(H,150,183)(H,151,182)(H,152,185)(H,153,189)(H,154,195)(H,155,196)(H,156,194)(H,157,190)(H,158,179)(H,159,180)(H,160,184)(H,161,191)(H,169,170)(H,171,172)(H,173,174)(H,175,176)(H,177,178)(H,198,199)/t65-,66-,67+,68+,69+,70+,85-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,111-,112-,113-,114-,115-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 integrase strand transfer step				Bioorg Med Chem Lett 16: 5199-202 (2006) Article DOI: 10.1016/j.bmcl.2006.07.022 BindingDB Entry DOI: 10.7270/Q20G3JSH
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50192263 (CHEMBL437239 | LQDSGLEVNIVTDSQYALGI) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(O)=O Show InChI InChI=1S/C93H151N23O34/c1-17-45(13)73(115-87(143)58(33-65(97)123)108-89(145)71(43(9)10)113-82(138)54(25-28-68(126)127)103-84(140)56(31-42(7)8)101-66(124)36-99-79(135)61(38-117)110-85(141)59(34-69(128)129)107-80(136)52(23-26-63(95)121)102-77(133)51(94)29-40(3)4)91(147)114-72(44(11)12)90(146)116-75(48(16)119)92(148)109-60(35-70(130)131)86(142)111-62(39-118)88(144)104-53(24-27-64(96)122)81(137)106-57(32-49-19-21-50(120)22-20-49)83(139)100-47(15)76(132)105-55(30-41(5)6)78(134)98-37-67(125)112-74(93(149)150)46(14)18-2/h19-22,40-48,51-62,71-75,117-120H,17-18,23-39,94H2,1-16H3,(H2,95,121)(H2,96,122)(H2,97,123)(H,98,134)(H,99,135)(H,100,139)(H,101,124)(H,102,133)(H,103,140)(H,104,144)(H,105,132)(H,106,137)(H,107,136)(H,108,145)(H,109,148)(H,110,141)(H,111,142)(H,112,125)(H,113,138)(H,114,147)(H,115,143)(H,116,146)(H,126,127)(H,128,129)(H,130,131)(H,149,150)/t45-,46-,47-,48+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,71-,72-,73-,74-,75-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 integrase strand transfer step				Bioorg Med Chem Lett 16: 5199-202 (2006) Article DOI: 10.1016/j.bmcl.2006.07.022 BindingDB Entry DOI: 10.7270/Q20G3JSH
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50192260 (CHEMBL414737 | PDIVIYQYMDDLYVGSDLEI) Show SMILES CC[C@H](C)C(NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O Show InChI InChI=1S/C108H161N21O36S/c1-16-55(12)87(128-105(161)86(54(10)11)126-107(163)88(56(13)17-2)127-102(158)76(48-84(144)145)120-90(146)64-20-19-38-110-64)106(162)124-71(43-59-23-29-62(132)30-24-59)97(153)113-65(33-35-78(109)134)91(147)118-70(42-58-21-27-61(131)28-22-58)96(152)115-67(37-39-166-15)92(148)121-73(45-81(138)139)100(156)122-74(46-82(140)141)98(154)117-69(41-52(6)7)95(151)119-72(44-60-25-31-63(133)32-26-60)101(157)125-85(53(8)9)104(160)111-49-79(135)112-77(50-130)103(159)123-75(47-83(142)143)99(155)116-68(40-51(4)5)94(150)114-66(34-36-80(136)137)93(149)129-89(108(164)165)57(14)18-3/h21-32,51-57,64-77,85-89,110,130-133H,16-20,33-50H2,1-15H3,(H2,109,134)(H,111,160)(H,112,135)(H,113,153)(H,114,150)(H,115,152)(H,116,155)(H,117,154)(H,118,147)(H,119,151)(H,120,146)(H,121,148)(H,122,156)(H,123,159)(H,124,162)(H,125,157)(H,126,163)(H,127,158)(H,128,161)(H,129,149)(H,136,137)(H,138,139)(H,140,141)(H,142,143)(H,144,145)(H,164,165)/t55-,56-,57-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,85-,86-,87-,88-,89?/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase C130S mutant strand transfer step				Bioorg Med Chem Lett 16: 5199-202 (2006) Article DOI: 10.1016/j.bmcl.2006.07.022 BindingDB Entry DOI: 10.7270/Q20G3JSH
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50191243 (CHEMBL427235 | H-TAYFLLKLAGRW-NH2) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:8.13,44.54,69.71,63.66,25.29,78.79,61.63,wD:33.41,4.4,56.58,89.90,17.21,(22.84,-19.95,;22.84,-18.4,;24.18,-17.63,;21.51,-17.63,;21.51,-16.09,;20.17,-15.32,;18.84,-16.09,;18.84,-17.63,;17.51,-15.32,;17.51,-13.78,;18.84,-13.01,;18.84,-11.47,;20.17,-10.7,;20.17,-9.16,;16.18,-16.09,;14.84,-15.32,;14.84,-13.78,;13.51,-16.09,;13.51,-17.63,;14.84,-18.4,;14.84,-19.95,;16.18,-17.63,;12.17,-15.32,;10.84,-16.09,;10.84,-17.63,;9.5,-15.32,;9.5,-13.78,;10.84,-13.01,;12.17,-13.78,;10.84,-11.47,;8.17,-16.09,;6.84,-15.32,;6.84,-13.78,;5.5,-16.09,;5.5,-17.63,;6.84,-18.4,;6.84,-19.95,;8.16,-20.71,;9.5,-19.95,;9.49,-18.4,;8.17,-17.63,;4.17,-15.32,;2.83,-16.09,;2.83,-17.63,;1.5,-15.32,;1.5,-13.78,;2.83,-13.01,;4.17,-13.79,;5.5,-13.02,;5.5,-11.48,;6.84,-10.71,;4.16,-10.71,;2.83,-11.48,;.16,-16.09,;-1.17,-15.32,;-1.17,-13.78,;-2.51,-16.09,;-2.51,-17.63,;-3.83,-15.32,;-5.17,-16.09,;-5.17,-17.63,;-6.5,-15.32,;-7.84,-16.09,;-6.5,-13.78,;-7.84,-13.01,;-5.17,-13.01,;22.84,-15.32,;22.84,-13.78,;24.18,-16.09,;25.51,-15.32,;25.51,-13.78,;26.85,-16.09,;26.85,-17.63,;28.18,-15.32,;29.51,-16.09,;30.84,-15.32,;30.84,-13.78,;32.18,-16.09,;33.51,-15.32,;33.51,-13.78,;34.85,-13.01,;34.85,-11.47,;36.18,-10.7,;36.18,-9.16,;37.52,-8.39,;34.85,-8.39,;34.85,-16.09,;34.85,-17.63,;36.18,-15.32,;37.52,-16.09,;37.52,-17.63,;38.84,-18.41,;40.34,-18,;41.18,-19.29,;40.21,-20.49,;40.45,-22,;39.26,-22.96,;37.82,-22.41,;37.58,-20.89,;38.77,-19.93,;38.84,-15.32,;40.18,-16.09,;38.85,-13.78,)| Show InChI InChI=1S/C71H108N18O14/c1-38(2)30-53(65(98)80-41(7)61(94)79-37-58(92)82-50(23-17-29-77-71(75)76)63(96)84-52(60(74)93)35-46-36-78-49-21-14-13-20-48(46)49)86-64(97)51(22-15-16-28-72)83-66(99)54(31-39(3)4)87-67(100)55(32-40(5)6)88-69(102)57(33-44-18-11-10-12-19-44)89-68(101)56(34-45-24-26-47(91)27-25-45)85-62(95)42(8)81-70(103)59(73)43(9)90/h10-14,18-21,24-27,36,38-43,50-57,59,78,90-91H,15-17,22-23,28-35,37,72-73H2,1-9H3,(H2,74,93)(H,79,94)(H,80,98)(H,81,103)(H,82,92)(H,83,99)(H,84,96)(H,85,95)(H,86,97)(H,87,100)(H,88,102)(H,89,101)(H4,75,76,77)/t41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,59-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Graduate School of the Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of wild type HIV1 integrase strand transfer activity				J Med Chem 49: 4477-86 (2006) Article DOI: 10.1021/jm060307u BindingDB Entry DOI: 10.7270/Q2736QJZ
					More data for this Ligand-Target Pair

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