Compile Data Set for Download or QSAR

Found 25 hits Enz. Inhib. hit(s) with all data for entry = 50037699   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Integrase (Human immunodeficiency virus 1)	BDBM50184633 (6-(3,4-dichlorophenyl)-2-hydroxy-4-oxohex-2-enoic ...) Show SMILES OC(=O)C(=O)CC(=O)CCc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C12H10Cl2O4/c13-9-4-2-7(5-10(9)14)1-3-8(15)6-11(16)12(17)18/h2,4-5H,1,3,6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM23399 (4-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2,4-...) Show SMILES OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1 Show InChI InChI=1S/C15H12FNO4/c16-11-5-3-10(4-6-11)9-17-7-1-2-12(17)13(18)8-14(19)15(20)21/h1-7H,8-9H2,(H,20,21)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM107693 ((2Z)-4-(5-chloro-1H-indol-3-yl)-2-hydroxy-4-oxobut...) Show SMILES OC(=O)C(=O)CC(=O)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C12H8ClNO4/c13-6-1-2-9-7(3-6)8(5-14-9)10(15)4-11(16)12(17)18/h1-3,5,14H,4H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184626 (6-(2-chlorophenyl)-2,4,6-trioxohexanoic acid | CHE...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1Cl Show InChI InChI=1S/C12H9ClO5/c13-9-4-2-1-3-8(9)10(15)5-7(14)6-11(16)12(17)18/h1-4H,5-6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM23399 (4-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2,4-...) Show SMILES OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1 Show InChI InChI=1S/C15H12FNO4/c16-11-5-3-10(4-6-11)9-17-7-1-2-12(17)13(18)8-14(19)15(20)21/h1-7H,8-9H2,(H,20,21)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM107693 ((2Z)-4-(5-chloro-1H-indol-3-yl)-2-hydroxy-4-oxobut...) Show SMILES OC(=O)C(=O)CC(=O)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C12H8ClNO4/c13-6-1-2-9-7(3-6)8(5-14-9)10(15)4-11(16)12(17)18/h1-3,5,14H,4H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184626 (6-(2-chlorophenyl)-2,4,6-trioxohexanoic acid | CHE...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1Cl Show InChI InChI=1S/C12H9ClO5/c13-9-4-2-1-3-8(9)10(15)5-7(14)6-11(16)12(17)18/h1-4H,5-6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase in pre-integration complex				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184632 (6-(naphthalen-1-yl)-2,4,6-trioxohexanoic acid | CH...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1cccc2ccccc12 Show InChI InChI=1S/C16H12O5/c17-11(9-15(19)16(20)21)8-14(18)13-7-3-5-10-4-1-2-6-12(10)13/h1-7H,8-9H2,(H,20,21)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184626 (6-(2-chlorophenyl)-2,4,6-trioxohexanoic acid | CHE...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1Cl Show InChI InChI=1S/C12H9ClO5/c13-9-4-2-1-3-8(9)10(15)5-7(14)6-11(16)12(17)18/h1-4H,5-6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184630 (6-biphenyl-4-yl-2,4,6-trioxo-hexanoic acid | CHEMB...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C18H14O5/c19-15(11-17(21)18(22)23)10-16(20)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,22,23)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184635 (6-(2-fluorophenyl)-2,4,6-trioxohexanoic acid | CHE...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1F Show InChI InChI=1S/C12H9FO5/c13-9-4-2-1-3-8(9)10(15)5-7(14)6-11(16)12(17)18/h1-4H,5-6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184624 (6-(2-methoxyphenyl)-2,4,6-trioxohexanoic acid | CH...) Show SMILES COc1ccccc1C(=O)CC(=O)CC(=O)C(O)=O Show InChI InChI=1S/C13H12O6/c1-19-12-5-3-2-4-9(12)10(15)6-8(14)7-11(16)13(17)18/h2-5H,6-7H2,1H3,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184625 (6-(2-bromophenyl)-2-hydroxy-4-oxohex-2-enoic acid ...) Show SMILES OC(=O)C(=O)CC(=O)CCc1ccccc1Br Show InChI InChI=1S/C12H11BrO4/c13-10-4-2-1-3-8(10)5-6-9(14)7-11(15)12(16)17/h1-4H,5-7H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184623 (2,4,6-trioxo-6-(2-(trifluoromethyl)phenyl)hexanoic...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1C(F)(F)F Show InChI InChI=1S/C13H9F3O5/c14-13(15,16)9-4-2-1-3-8(9)10(18)5-7(17)6-11(19)12(20)21/h1-4H,5-6H2,(H,20,21)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184638 (6-(naphthalen-2-yl)-2,4,6-trioxohexanoic acid | CH...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C16H12O5/c17-13(9-15(19)16(20)21)8-14(18)12-6-5-10-3-1-2-4-11(10)7-12/h1-7H,8-9H2,(H,20,21)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184631 (6-(2-(benzyloxy)phenyl)-2,4,6-trioxohexanoic acid ...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1OCc1ccccc1 Show InChI InChI=1S/C19H16O6/c20-14(11-17(22)19(23)24)10-16(21)15-8-4-5-9-18(15)25-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,23,24)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184637 (6-(3-chlorophenyl)-2,4,6-trioxohexanoic acid | CHE...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C12H9ClO5/c13-8-3-1-2-7(4-8)10(15)5-9(14)6-11(16)12(17)18/h1-4H,5-6H2,(H,17,18)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184622 (6-(2-chlorophenyl)-2-hydroxy-4-oxohex-2-enoic acid...) Show SMILES OC(=O)C(=O)CC(=O)CCc1ccccc1Cl Show InChI InChI=1S/C12H11ClO4/c13-10-4-2-1-3-8(10)5-6-9(14)7-11(15)12(16)17/h1-4H,5-7H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184622 (6-(2-chlorophenyl)-2-hydroxy-4-oxohex-2-enoic acid...) Show SMILES OC(=O)C(=O)CC(=O)CCc1ccccc1Cl Show InChI InChI=1S/C12H11ClO4/c13-10-4-2-1-3-8(10)5-6-9(14)7-11(15)12(16)17/h1-4H,5-7H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184628 (2-hydroxy-4-oxo-6-phenylhex-2-enoic acid | CHEMBL2...) Show SMILES OC(=O)C(=O)CC(=O)CCc1ccccc1 Show InChI InChI=1S/C12H12O4/c13-10(8-11(14)12(15)16)7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,15,16)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184634 (2,4,6-trioxo-6-phenylhexanoic acid | CHEMBL448424) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1 Show InChI InChI=1S/C12H10O5/c13-9(7-11(15)12(16)17)6-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184636 (2,4,6-trioxo-6-(pyridin-2-yl)hexanoic acid | CHEMB...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1ccccn1 Show InChI InChI=1S/C11H9NO5/c13-7(6-10(15)11(16)17)5-9(14)8-3-1-2-4-12-8/h1-4H,5-6H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG 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
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184639 (1-(1-(4-fluorobenzyl)-1H-pyrrol-2-yl)-3-(1H-tetraz...) Show SMILES Fc1ccc(Cn2cccc2C(=O)CC(=O)c2nnn[nH]2)cc1 Show InChI InChI=1S/C15H12FN5O2/c16-11-5-3-10(4-6-11)9-21-7-1-2-12(21)13(22)8-14(23)15-17-19-20-18-15/h1-7H,8-9H2,(H,17,18,19,20)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184627 (1-(2-chlorophenyl)-5-(1H-tetrazol-5-yl)pentane-1,3...) Show SMILES Clc1ccccc1C(=O)CC(=O)CC(=O)c1nnn[nH]1 Show InChI InChI=1S/C12H9ClN4O3/c13-9-4-2-1-3-8(9)10(19)5-7(18)6-11(20)12-14-16-17-15-12/h1-4H,5-6H2,(H,14,15,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50184621 (2,4,6-trioxo-6-(pyridin-3-yl)hexanoic acid | CHEMB...) Show SMILES OC(=O)C(=O)CC(=O)CC(=O)c1cccnc1 Show InChI InChI=1S/C11H9NO5/c13-8(5-10(15)11(16)17)4-9(14)7-2-1-3-12-6-7/h1-3,6H,4-5H2,(H,16,17)	PDB MMDB UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase				Bioorg Med Chem Lett 16: 2920-4 (2006) Article DOI: 10.1016/j.bmcl.2006.03.010 BindingDB Entry DOI: 10.7270/Q2BV7HDK
					More data for this Ligand-Target Pair