Compile Data Set for Download or QSAR

Found 56 hits with Last Name = 'weitman' and Initial = 'm'   

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
Cholinesterase (Equus caballus (Horse))	BDBM50400024 (CHEMBL2177719) Show SMILES CCN(C)C(=O)Oc1cccc2NCC(CCN)c12 Show InChI InChI=1S/C14H21N3O2/c1-3-17(2)14(18)19-12-6-4-5-11-13(12)10(7-8-15)9-16-11/h4-6,10,16H,3,7-9,15H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50400020 (CHEMBL2181475) Show SMILES CCN(C)C(=O)Oc1cccc2NCC(CCC(=O)OC)c12 Show InChI InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-13-7-5-6-12-15(13)11(10-17-12)8-9-14(19)21-3/h5-7,11,17H,4,8-10H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013328 (CHEMBL3263347) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2NCC(CCN(C)C)c12 Show InChI InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-14-8-6-7-13-15(14)12(11-17-13)9-10-18(2)3;/h6-8,12,17H,5,9-11H2,1-4H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50400024 (CHEMBL2177719) Show SMILES CCN(C)C(=O)Oc1cccc2NCC(CCN)c12 Show InChI InChI=1S/C14H21N3O2/c1-3-17(2)14(18)19-12-6-4-5-11-13(12)10(7-8-15)9-16-11/h4-6,10,16H,3,7-9,15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL 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
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50400027 (CHEMBL2177716) Show SMILES CCN(C)C(=O)Oc1cccc2N(CCC(=O)OC)CCc12 Show InChI InChI=1S/C16H22N2O4/c1-4-17(2)16(20)22-14-7-5-6-13-12(14)8-10-18(13)11-9-15(19)21-3/h5-7H,4,8-11H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013334 (CHEMBL3263351) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2N(CCCN(C)C)CCc12 Show InChI InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-16-9-6-8-15-14(16)10-13-20(15)12-7-11-18(2)3;/h6,8-9H,5,7,10-13H2,1-4H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013332 (CHEMBL3263349) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2NCC(CCCN)c12 Show InChI InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-13-8-4-7-12-14(13)11(10-17-12)6-5-9-16;/h4,7-8,11,17H,3,5-6,9-10,16H2,1-2H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013328 (CHEMBL3263347) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2NCC(CCN(C)C)c12 Show InChI InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-14-8-6-7-13-15(14)12(11-17-13)9-10-18(2)3;/h6-8,12,17H,5,9-11H2,1-4H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM1434 (11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3...) Show SMILES Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12 Show InChI InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013332 (CHEMBL3263349) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2NCC(CCCN)c12 Show InChI InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-13-8-4-7-12-14(13)11(10-17-12)6-5-9-16;/h4,7-8,11,17H,3,5-6,9-10,16H2,1-2H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013331 (CHEMBL3263348) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2C(CCN(C)C)CNc2c1 Show InChI InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-13-6-7-14-12(8-9-18(2)3)11-17-15(14)10-13;/h6-7,10,12,17H,5,8-9,11H2,1-4H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16189 (4-(3-Iodophenyl)-3-oxobutanenitrile | beta-ketonit...) Show SMILES Ic1cccc(CC(=O)CC#N)c1 Show InChI InChI=1S/C10H8INO/c11-9-3-1-2-8(6-9)7-10(13)4-5-12/h1-3,6H,4,7H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013334 (CHEMBL3263351) Show SMILES Cl.CCN(C)C(=O)Oc1cccc2N(CCCN(C)C)CCc12 Show InChI InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-16-9-6-8-15-14(16)10-13-20(15)12-7-11-18(2)3;/h6,8-9H,5,7,10-13H2,1-4H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50400009 (CHEMBL2177708) Show SMILES CCN(C)C(=O)Oc1ccc2C(CCC(=O)OC)CNc2c1 Show InChI InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-12-6-7-13-11(5-8-15(19)21-3)10-17-14(13)9-12/h6-7,9,11,17H,4-5,8,10H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16185 (3-(3-Chlorophenyl)-3-oxopropanenitrile | beta-keto...) Show SMILES Clc1cccc(c1)C(=O)CC#N Show InChI InChI=1S/C9H6ClNO/c10-8-3-1-2-7(6-8)9(12)4-5-11/h1-3,6H,4H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013382 (CHEMBL3263352) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2CCN(CCCN(C)C)c2c1 Show InChI InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-15-8-7-14-9-12-20(16(14)13-15)11-6-10-18(2)3;/h7-8,13H,5-6,9-12H2,1-4H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50013333 (CHEMBL3263350) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2C(CCCN)CNc2c1 Show InChI InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-12-6-7-13-11(5-4-8-16)10-17-14(13)9-12;/h6-7,9,11,17H,3-5,8,10,16H2,1-2H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50400027 (CHEMBL2177716) Show SMILES CCN(C)C(=O)Oc1cccc2N(CCC(=O)OC)CCc12 Show InChI InChI=1S/C16H22N2O4/c1-4-17(2)16(20)22-14-7-5-6-13-12(14)8-10-18(13)11-9-15(19)21-3/h5-7H,4,8-11H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50400025 (CHEMBL2177718) Show SMILES CCN(C)C(=O)Oc1ccc2CCN(CCC(=O)OC)c2c1 Show InChI InChI=1S/C16H22N2O4/c1-4-17(2)16(20)22-13-6-5-12-7-9-18(14(12)11-13)10-8-15(19)21-3/h5-6,11H,4,7-10H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of BuChE in equine serum using butylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50400020 (CHEMBL2181475) Show SMILES CCN(C)C(=O)Oc1cccc2NCC(CCC(=O)OC)c12 Show InChI InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-13-7-5-6-12-15(13)11(10-17-12)8-9-14(19)21-3/h5-7,11,17H,4,8-10H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt 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
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Dimer of Gag-Pol polyprotein [600-1159,L699I,K702N,C879S] (Human immunodeficiency virus type 1)	BDBM16189 (4-(3-Iodophenyl)-3-oxobutanenitrile | beta-ketonit...) Show SMILES Ic1cccc(CC(=O)CC#N)c1 Show InChI InChI=1S/C10H8INO/c11-9-3-1-2-8(6-9)7-10(13)4-5-12/h1-3,6H,4,7H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.40E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16187 (3-(3-benzoylphenyl)-3-oxopropanenitrile | 3-Benzoy...) Show SMILES O=C(CC#N)c1cccc(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C16H11NO2/c17-10-9-15(18)13-7-4-8-14(11-13)16(19)12-5-2-1-3-6-12/h1-8,11H,9H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1159,Y780C]/Imidazoleglycerol-phosphate dehydratase [600-1029,Y780C] (Human immunodeficiency virus type 1)	BDBM16189 (4-(3-Iodophenyl)-3-oxobutanenitrile | beta-ketonit...) Show SMILES Ic1cccc(CC(=O)CC#N)c1 Show InChI InChI=1S/C10H8INO/c11-9-3-1-2-8(6-9)7-10(13)4-5-12/h1-3,6H,4,7H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16196 (4-(3-Bromo-4-chlorophenyl)-1H-imidazole-5-carboxam...) Show SMILES NC(=O)c1[nH]cnc1-c1ccc(Cl)c(Br)c1 Show InChI InChI=1S/C10H7BrClN3O/c11-6-3-5(1-2-7(6)12)8-9(10(13)16)15-4-14-8/h1-4H,(H2,13,16)(H,14,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16208 (4-(3-Benzoylphenyl)thiazole-5-carboxamide | 4-(3-b...) Show SMILES NC(=O)c1scnc1-c1cccc(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C17H12N2O2S/c18-17(21)16-14(19-10-22-16)12-7-4-8-13(9-12)15(20)11-5-2-1-3-6-11/h1-10H,(H2,18,21)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Dimer of Gag-Pol polyprotein [600-1159,L699I,K702N,C879S] (Human immunodeficiency virus type 1)	BDBM16196 (4-(3-Bromo-4-chlorophenyl)-1H-imidazole-5-carboxam...) Show SMILES NC(=O)c1[nH]cnc1-c1ccc(Cl)c(Br)c1 Show InChI InChI=1S/C10H7BrClN3O/c11-6-3-5(1-2-7(6)12)8-9(10(13)16)15-4-14-8/h1-4H,(H2,13,16)(H,14,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.98E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013331 (CHEMBL3263348) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2C(CCN(C)C)CNc2c1 Show InChI InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-13-6-7-14-12(8-9-18(2)3)11-17-15(14)10-13;/h6-7,10,12,17H,5,8-9,11H2,1-4H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1159,Y780C]/Imidazoleglycerol-phosphate dehydratase [600-1029,Y780C] (Human immunodeficiency virus type 1)	BDBM16196 (4-(3-Bromo-4-chlorophenyl)-1H-imidazole-5-carboxam...) Show SMILES NC(=O)c1[nH]cnc1-c1ccc(Cl)c(Br)c1 Show InChI InChI=1S/C10H7BrClN3O/c11-6-3-5(1-2-7(6)12)8-9(10(13)16)15-4-14-8/h1-4H,(H2,13,16)(H,14,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.64E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16191 (3-(3-Iodophenyl)-3-oxopropanamide | beta-ketoamide...) Show SMILES NC(=O)CC(=O)c1cccc(I)c1 Show InChI InChI=1S/C9H8INO2/c10-7-3-1-2-6(4-7)8(12)5-9(11)13/h1-4H,5H2,(H2,11,13)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.96E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16188 (3-Phenyl-3-oxopropanenitrile | 3-oxo-3-(3-phenylph...) Show SMILES O=C(CC#N)c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C15H11NO/c16-10-9-15(17)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-8,11H,9H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.34E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013333 (CHEMBL3263350) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2C(CCCN)CNc2c1 Show InChI InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-12-6-7-13-11(5-4-8-16)10-17-14(13)9-12;/h6-7,9,11,17H,3-5,8,10,16H2,1-2H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16203 (2-Amino-4-(3-benzoylphenyl)thiazole-5-carboxamide ...) Show SMILES NC(=O)c1sc(N)nc1-c1cccc(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C17H13N3O2S/c18-16(22)15-13(20-17(19)23-15)11-7-4-8-12(9-11)14(21)10-5-2-1-3-6-10/h1-9H,(H2,18,22)(H2,19,20)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50013382 (CHEMBL3263352) Show SMILES Cl.CCN(C)C(=O)Oc1ccc2CCN(CCCN(C)C)c2c1 Show InChI InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-15-8-7-14-9-12-20(16(14)13-15)11-6-10-18(2)3;/h7-8,13H,5-6,9-12H2,1-4H3;1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16201 (2-Amino-4-(3-chlorophenyl)thiazole-5-carboxamide |...) Show SMILES NC(=O)c1sc(N)nc1-c1cccc(Cl)c1 Show InChI InChI=1S/C10H8ClN3OS/c11-6-3-1-2-5(4-6)7-8(9(12)15)16-10(13)14-7/h1-4H,(H2,12,15)(H2,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.44E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50400009 (CHEMBL2177708) Show SMILES CCN(C)C(=O)Oc1ccc2C(CCC(=O)OC)CNc2c1 Show InChI InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-12-6-7-13-11(5-8-15(19)21-3)10-17-14(13)9-12/h6-7,9,11,17H,4-5,8,10H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocytes using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem Lett 24: 2283-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.081 BindingDB Entry DOI: 10.7270/Q21V5GHZ
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16204 (2-Amino-4-(3-phenylphenyl)thiazole-5-carboxamide |...) Show SMILES NC(=O)c1sc(N)nc1-c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C16H13N3OS/c17-15(20)14-13(19-16(18)21-14)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H,(H2,17,20)(H2,18,19)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16190 (3-(2-Cyanoacetyl)phenyl Diethyl Phosphate | [3-(2-...) Show SMILES CCOP(=O)(OCC)Oc1cccc(c1)C(=O)CC#N Show InChI InChI=1S/C13H16NO5P/c1-3-17-20(16,18-4-2)19-12-7-5-6-11(10-12)13(15)8-9-14/h5-7,10H,3-4,8H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.43E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Dimer of Gag-Pol polyprotein [600-1159,L699I,K702N,C879S] (Human immunodeficiency virus type 1)	BDBM1434 (11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3...) Show SMILES Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12 Show InChI InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	7.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16195 (4-(3-Chlorophenyl)-1H-imidazole-5-carboxamide | Im...) Show SMILES NC(=O)c1[nH]cnc1-c1cccc(Cl)c1 Show InChI InChI=1S/C10H8ClN3O/c11-7-3-1-2-6(4-7)8-9(10(12)15)14-5-13-8/h1-5H,(H2,12,15)(H,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.98E+4	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16205 (2-Amino-4-phenylthiazole-5-carboxamide | 2-amino-4...) Show SMILES NC(=O)c1sc(N)nc1-c1ccccc1 Show InChI InChI=1S/C10H9N3OS/c11-9(14)8-7(13-10(12)15-8)6-4-2-1-3-5-6/h1-5H,(H2,11,14)(H2,12,13)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16207 (4-(3-Bromo-4-chlorophenyl)thiazole-5-carboxamide |...) Show SMILES NC(=O)c1scnc1-c1ccc(Cl)c(Br)c1 Show InChI InChI=1S/C10H6BrClN2OS/c11-6-3-5(1-2-7(6)12)8-9(10(13)15)16-4-14-8/h1-4H,(H2,13,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1159,Y780C]/Imidazoleglycerol-phosphate dehydratase [600-1029,Y780C] (Human immunodeficiency virus type 1)	BDBM1434 (11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3...) Show SMILES Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12 Show InChI InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16202 (2-Amino-4-(3-bromo-4-chlorophenyl)thiazole-5-carbo...) Show SMILES NC(=O)c1sc(N)nc1-c1ccc(Cl)c(Br)c1 Show InChI InChI=1S/C10H7BrClN3OS/c11-5-3-4(1-2-6(5)12)7-8(9(13)16)17-10(14)15-7/h1-3H,(H2,13,16)(H2,14,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.18E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16200 (2-Amino-4-(3-iodophenyl)thiazole-5-carboxamide | 2...) Show SMILES NC(=O)c1sc(N)nc1-c1cccc(I)c1 Show InChI InChI=1S/C10H8IN3OS/c11-6-3-1-2-5(4-6)7-8(9(12)15)16-10(13)14-7/h1-4H,(H2,12,15)(H2,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16210 (4-Phenylthiazole-5-carboxamide | 4-phenyl-1,3-thia...) Show SMILES NC(=O)c1scnc1-c1ccccc1 Show InChI InChI=1S/C10H8N2OS/c11-10(13)9-8(12-6-14-9)7-4-2-1-3-5-7/h1-6H,(H2,11,13)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.83E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16199 (4-Phenyl-1H-imidazole-5-carboxamide | Imidazole 8g) Show SMILES NC(=O)c1[nH]cnc1-c1ccccc1 Show InChI InChI=1S/C10H9N3O/c11-10(14)9-8(12-6-13-9)7-4-2-1-3-5-7/h1-6H,(H2,11,14)(H,12,13)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	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
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16198 (4-(3-Phenylphenyl)-1H-imidazole-5-carboxamide | Im...) Show SMILES NC(=O)c1[nH]cnc1-c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C16H13N3O/c17-16(20)15-14(18-10-19-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,20)(H,18,19)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.12E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16197 (4-(3-Benzoylphenyl)-1H-imidazole-5-carboxamide | I...) Show SMILES NC(=O)c1[nH]cnc1-c1cccc(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C17H13N3O2/c18-17(22)15-14(19-10-20-15)12-7-4-8-13(9-12)16(21)11-5-2-1-3-6-11/h1-10H,(H2,18,22)(H,19,20)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.12E+5	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16194 (3-Oxo-3-(3-phenylphenyl)propanamide | beta-ketoami...) Show SMILES NC(=O)CC(=O)c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C15H13NO2/c16-15(18)10-14(17)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,18)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.12E+5	n/a	n/a	n/a	n/a	7.5	37
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S] (Human immunodeficiency virus type 1)	BDBM16206 (4-(3-Iodophenyl)thiazole-5-carboxamide | 4-(3-iodo...) Show SMILES NC(=O)c1scnc1-c1cccc(I)c1 Show InChI InChI=1S/C10H7IN2OS/c11-7-3-1-2-6(4-7)8-9(10(12)14)15-5-13-8/h1-5H,(H2,12,14)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.12E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 50: 2370-84 (2007) Article DOI: 10.1021/jm0613121 BindingDB Entry DOI: 10.7270/Q2VM49J0
					More data for this Ligand-Target Pair

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