Compile Data Set for Download or QSAR

Found 32 hits Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4 [K6R,T557I]' AND taxid = 9606   

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
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM50228403 ((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...) Show SMILES CC#CCn1c(nc2n(C)c(=O)n(Cc3nc(C)c4ccccc4n3)c(=O)c12)N1CCC[C@@H](N)C1 Show InChI InChI=1S/C25H28N8O2/c1-4-5-13-32-21-22(29-24(32)31-12-8-9-17(26)14-31)30(3)25(35)33(23(21)34)15-20-27-16(2)18-10-6-7-11-19(18)28-20/h6-7,10-11,17H,8-9,12-15,26H2,1-3H3/t17-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM16285 (2-({6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-di...) Show SMILES Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O |r| Show InChI InChI=1S/C18H21N5O2/c1-21-17(24)9-16(22-8-4-7-15(20)12-22)23(18(21)25)11-14-6-3-2-5-13(14)10-19/h2-3,5-6,9,15H,4,7-8,11-12,20H2,1H3/t15-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM11162 ((1R)-3-oxo-3-[3-(trifluoroethyl)-5,6-dihydro[1,2,4...) Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F |r| Show InChI InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167935 (1,5-Dimethyl-2-phenyl-4-(6-(phenylsulfonyl)tetrazo...) Show SMILES Cc1c(-c2c(cnc3nnnn23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(2.21,6.35,;3.68,6.83,;4.92,5.92,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;7.59,4.38,;6.82,5.72,;8.36,3.05,;8.92,5.15,;8.92,6.69,;10.26,7.46,;11.59,6.69,;11.59,5.15,;10.26,4.38,;6.17,6.83,;7.63,6.35,;5.69,8.29,;6.6,9.54,;5.97,10.95,;6.88,12.19,;8.41,12.03,;9.04,10.62,;8.13,9.38,;4.15,8.29,;3.25,9.54,)| Show InChI InChI=1S/C21H17N7O3S/c1-14-18(20(29)28(26(14)2)15-9-5-3-6-10-15)19-17(13-22-21-23-24-25-27(19)21)32(30,31)16-11-7-4-8-12-16/h3-13H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167938 (1',5'-Dimethyl-2'-phenyl-5-(phenylsulf...) Show SMILES Cc1c(-c2cc(n[nH]2)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C Show InChI InChI=1S/C20H18N4O3S/c1-14-19(20(25)24(23(14)2)15-9-5-3-6-10-15)17-13-18(22-21-17)28(26,27)16-11-7-4-8-12-16/h3-13H,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM170166 ((R)-40) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-c3ccccc3C#N)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H](-[#7])-[#6]-1 |r| Show InChI InChI=1S/C24H29N7O2/c1-16(2)10-12-30-20-21(27-23(30)29-11-6-9-19(26)15-29)28(3)24(33)31(22(20)32)14-18-8-5-4-7-17(18)13-25/h4-5,7-8,10,19H,6,9,11-12,14-15,26H2,1-3H3/t19-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23.5	n/a	n/a	n/a	n/a	n/a	n/a
West China Hospital					Assay Description DPP-IV inhibition was measured by DPP-IV inhibitor screening assay kit (Cayman Chemical Company, Item No. 700210) following the manufacturer's in...				Chem Biol Drug Des 87: 290-5 (2016) Article DOI: 10.1111/cbdd.12663 BindingDB Entry DOI: 10.7270/Q2NV9H16
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM170168 ((R)-43) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-c3nc4ccccc4s3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H](-[#7])-[#6]-1 |r| Show InChI InChI=1S/C24H29N7O2S/c1-15(2)10-12-30-20-21(27-23(30)29-11-6-7-16(25)13-29)28(3)24(33)31(22(20)32)14-19-26-17-8-4-5-9-18(17)34-19/h4-5,8-10,16H,6-7,11-14,25H2,1-3H3/t16-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36.2	n/a	n/a	n/a	n/a	n/a	n/a
West China Hospital					Assay Description DPP-IV inhibition was measured by DPP-IV inhibitor screening assay kit (Cayman Chemical Company, Item No. 700210) following the manufacturer's in...				Chem Biol Drug Des 87: 290-5 (2016) Article DOI: 10.1111/cbdd.12663 BindingDB Entry DOI: 10.7270/Q2NV9H16
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM170169 ((S)-43) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-c3nc4ccccc4s3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@H](-[#7])-[#6]-1 |r| Show InChI InChI=1S/C24H29N7O2S/c1-15(2)10-12-30-20-21(27-23(30)29-11-6-7-16(25)13-29)28(3)24(33)31(22(20)32)14-19-26-17-8-4-5-9-18(17)34-19/h4-5,8-10,16H,6-7,11-14,25H2,1-3H3/t16-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36.9	n/a	n/a	n/a	n/a	n/a	n/a
West China Hospital					Assay Description DPP-IV inhibition was measured by DPP-IV inhibitor screening assay kit (Cayman Chemical Company, Item No. 700210) following the manufacturer's in...				Chem Biol Drug Des 87: 290-5 (2016) Article DOI: 10.1111/cbdd.12663 BindingDB Entry DOI: 10.7270/Q2NV9H16
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167943 (3-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1Hpyraz...) Show SMILES Cc1c(-c2c(C#N)c3nc4ccccc4n3cc2S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(19.46,-10.69,;19.94,-9.22,;19.03,-7.97,;17.49,-7.97,;16.72,-9.31,;17.49,-10.64,;18.26,-11.98,;15.18,-9.31,;14.15,-10.45,;12.74,-9.83,;11.34,-10.45,;10.09,-9.55,;10.25,-8.02,;11.66,-7.39,;12.9,-8.3,;14.41,-7.97,;15.18,-6.64,;16.72,-6.64,;17.49,-5.31,;18.82,-6.08,;16.16,-4.54,;18.26,-3.97,;19.8,-3.97,;20.57,-2.64,;19.8,-1.31,;18.26,-1.31,;17.49,-2.64,;19.94,-6.73,;19.46,-5.26,;21.4,-7.2,;22.65,-6.3,;24.05,-6.93,;25.3,-6.02,;25.14,-4.49,;23.73,-3.86,;22.48,-4.77,;21.4,-8.74,;22.65,-9.65,)| Show InChI InChI=1S/C29H21N5O3S/c1-19-26(29(35)34(32(19)2)20-11-5-3-6-12-20)27-22(17-30)28-31-23-15-9-10-16-24(23)33(28)18-25(27)38(36,37)21-13-7-4-8-14-21/h3-16,18H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>50	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167944 (1,5-Dimethyl-4-(3-methyl-1-phenyl-5-(phenylsulfony...) Show SMILES Cc1nn(-c2ccccc2)c2nc(-c3c(C)n(C)n(-c4ccccc4)c3=O)c(cc12)S(=O)(=O)c1ccccc1 |(-1.94,3.48,;-1.46,2.02,;-2.37,.77,;-1.46,-.48,;-1.94,-1.94,;-.91,-3.09,;-1.39,-4.55,;-2.89,-4.87,;-3.92,-3.73,;-3.45,-2.26,;;1.33,-.77,;2.67,,;4,-.77,;5.41,-.14,;5.73,1.36,;6.44,-1.29,;7.97,-1.13,;5.67,-2.62,;6.29,-4.03,;7.83,-4.19,;8.45,-5.6,;7.55,-6.84,;6.02,-6.68,;5.39,-5.27,;4.16,-2.3,;3.02,-3.33,;2.67,1.54,;1.33,2.31,;,1.54,;4,2.31,;4.77,.98,;5.33,3.08,;3.23,3.64,;1.69,3.64,;.92,4.98,;1.69,6.31,;3.23,6.31,;4,4.98,)| Show InChI InChI=1S/C30H25N5O3S/c1-20-25-19-26(39(37,38)24-17-11-6-12-18-24)28(31-29(25)34(32-20)22-13-7-4-8-14-22)27-21(2)33(3)35(30(27)36)23-15-9-5-10-16-23/h4-19H,1-3H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>50	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167936 (1,5-Dimethyl-2-phenyl-4-(3-(phenylsulfonyl)benzo[4...) Show SMILES Cc1c(-c2c(cnc3nc4ccccc4n23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(9.96,8.33,;8.42,8.41,;7.45,7.21,;7.85,5.72,;9.34,5.32,;9.74,3.84,;8.65,2.75,;7.16,3.15,;5.87,2.31,;4.67,3.28,;3.15,3.04,;2.18,4.23,;2.73,5.67,;4.26,5.91,;5.22,4.71,;6.76,4.63,;10.43,6.41,;9.34,7.5,;11.52,5.32,;11.52,7.5,;13,7.1,;14.09,8.19,;13.69,9.68,;12.21,10.08,;11.12,8.99,;6.02,7.76,;4.72,6.92,;6.1,9.3,;4.9,10.27,;5.14,11.79,;3.94,12.76,;2.51,12.21,;2.26,10.69,;3.46,9.72,;7.58,9.7,;8.14,11.14,)| Show InChI InChI=1S/C27H21N5O3S/c1-18-24(26(33)32(30(18)2)19-11-5-3-6-12-19)25-23(36(34,35)20-13-7-4-8-14-20)17-28-27-29-21-15-9-10-16-22(21)31(25)27/h3-17H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167932 (1,5-Dimethyl-2-phenyl-4-(6-(phenylsulfonyl)-[1,2,4...) Show SMILES Cc1c(-c2c(cnc3ncnn23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(2.21,6.35,;3.68,6.83,;4.92,5.92,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;7.59,4.38,;6.82,5.72,;8.36,3.05,;8.92,5.15,;8.92,6.69,;10.26,7.46,;11.59,6.69,;11.59,5.15,;10.26,4.38,;6.17,6.83,;7.63,6.35,;5.69,8.29,;6.6,9.54,;5.97,10.95,;6.88,12.19,;8.41,12.03,;9.04,10.62,;8.13,9.38,;4.15,8.29,;3.25,9.54,)| Show InChI InChI=1S/C22H18N6O3S/c1-15-19(21(29)28(26(15)2)16-9-5-3-6-10-16)20-18(13-23-22-24-14-25-27(20)22)32(30,31)17-11-7-4-8-12-17/h3-14H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM170167 ((S)-40) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-c3ccccc3C#N)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@H](-[#7])-[#6]-1 |r| Show InChI InChI=1S/C24H29N7O2/c1-16(2)10-12-30-20-21(27-23(30)29-11-6-9-19(26)15-29)28(3)24(33)31(22(20)32)14-18-8-5-4-7-17(18)13-25/h4-5,7-8,10,19H,6,9,11-12,14-15,26H2,1-3H3/t19-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
West China Hospital					Assay Description DPP-IV inhibition was measured by DPP-IV inhibitor screening assay kit (Cayman Chemical Company, Item No. 700210) following the manufacturer's in...				Chem Biol Drug Des 87: 290-5 (2016) Article DOI: 10.1111/cbdd.12663 BindingDB Entry DOI: 10.7270/Q2NV9H16
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167933 (7-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyra...) Show SMILES Cc1c(-c2c(cnc3c(cnn23)C#N)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(2.21,6.35,;3.68,6.83,;4.92,5.92,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;1.65,.13,;1.17,-1.33,;7.59,4.38,;6.82,5.72,;8.36,3.05,;8.92,5.15,;8.92,6.69,;10.26,7.46,;11.59,6.69,;11.59,5.15,;10.26,4.38,;6.17,6.83,;7.63,6.35,;5.69,8.29,;6.6,9.54,;5.97,10.95,;6.88,12.19,;8.41,12.03,;9.04,10.62,;8.13,9.38,;4.15,8.29,;3.25,9.54,)| Show InChI InChI=1S/C24H18N6O3S/c1-16-21(24(31)30(28(16)2)18-9-5-3-6-10-18)22-20(34(32,33)19-11-7-4-8-12-19)15-26-23-17(13-25)14-27-29(22)23/h3-12,14-15H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166622 ((2-(2,4-Dichlorophenyl)imidazo[1,2-a]pyridin-3-yl)...) Show SMILES NCc1c(nc2ccccn12)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C14H11Cl2N3/c15-9-4-5-10(11(16)7-9)14-12(8-17)19-6-2-1-3-13(19)18-14/h1-7H,8,17H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166624 ((2-(o-Tolyl)imidazo[1,2-a]pyridin-3-yl)methanamine...) Show SMILES Cc1ccccc1-c1nc2ccccn2c1CN Show InChI InChI=1S/C15H15N3/c1-11-6-2-3-7-12(11)15-13(10-16)18-9-5-4-8-14(18)17-15/h2-9H,10,16H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167934 (1,5-Dimethyl-2-phenyl-4-(2-phenyl-6-(phenylsulfony...) Show SMILES Cc1c(-c2c(cnc3cc(nn23)-c2ccccc2)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(2.21,6.35,;3.68,6.83,;4.92,5.92,;4.92,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;3.59,3.61,;-.32,2.84,;-1.09,1.51,;-2.63,1.51,;-3.4,2.84,;-2.63,4.18,;-1.09,4.18,;7.59,4.38,;6.82,5.72,;8.36,3.05,;8.92,5.15,;8.92,6.69,;10.26,7.46,;11.59,6.69,;11.59,5.15,;10.26,4.38,;6.17,6.83,;7.63,6.35,;5.69,8.29,;6.6,9.54,;5.97,10.95,;6.88,12.19,;8.41,12.03,;9.04,10.62,;8.13,9.38,;4.15,8.29,;3.25,9.54,)| Show InChI InChI=1S/C29H23N5O3S/c1-20-27(29(35)34(32(20)2)22-14-8-4-9-15-22)28-25(38(36,37)23-16-10-5-11-17-23)19-30-26-18-24(31-33(26)28)21-12-6-3-7-13-21/h3-19H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	313	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166623 ((2-(2,5-Dichlorophenyl)imidazo[1,2-a]pyridin-3-yl)...) Show SMILES NCc1c(nc2ccccn12)-c1cc(Cl)ccc1Cl Show InChI InChI=1S/C14H11Cl2N3/c15-9-4-5-11(16)10(7-9)14-12(8-17)19-6-2-1-3-13(19)18-14/h1-7H,8,17H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166627 ((7-Methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl)me...) Show SMILES Cc1ccc(cc1)-c1nc2cc(C)ccn2c1CN Show InChI InChI=1S/C16H17N3/c1-11-3-5-13(6-4-11)16-14(10-17)19-8-7-12(2)9-15(19)18-16/h3-9H,10,17H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166625 ((2-(4-Bromophenyl)imidazo[1,2-a]pyridin-3-yl)metha...) Show SMILES NCc1c(nc2ccccn12)-c1ccc(Br)cc1 Show InChI InChI=1S/C14H12BrN3/c15-11-6-4-10(5-7-11)14-12(9-16)18-8-2-1-3-13(18)17-14/h1-8H,9,16H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	940	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167939 (1',5'-Dimethyl-2,2'-diphenyl-5-(phenyl...) Show SMILES Cc1c(-c2cc(nn2-c2ccccc2)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(4.04,-11.23,;2.58,-10.76,;2.1,-9.29,;3.01,-8.05,;2.53,-6.58,;3.78,-5.68,;5.02,-6.58,;4.55,-8.05,;5.45,-9.29,;6.99,-9.13,;7.89,-10.38,;7.26,-11.78,;5.73,-11.94,;4.83,-10.7,;3.78,-4.14,;2.24,-4.14,;5.32,-4.14,;3.78,-2.6,;2.45,-1.83,;2.45,-.29,;3.78,.48,;5.11,-.29,;5.11,-1.83,;.56,-9.29,;-.34,-8.05,;.09,-10.76,;-1.38,-11.23,;-1.7,-12.74,;-3.16,-13.21,;-4.31,-12.18,;-3.99,-10.68,;-2.52,-10.2,;1.33,-11.66,;1.33,-13.2,)| Show InChI InChI=1S/C26H22N4O3S/c1-19-25(26(31)30(28(19)2)21-14-8-4-9-15-21)23-18-24(27-29(23)20-12-6-3-7-13-20)34(32,33)22-16-10-5-11-17-22/h3-18H,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.64E+3	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166621 ((2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-3-yl)meth...) Show SMILES NCc1c(nc2ccccn12)-c1ccc(Cl)cc1 Show InChI InChI=1S/C14H12ClN3/c15-11-6-4-10(5-7-11)14-12(9-16)18-8-2-1-3-13(18)17-14/h1-8H,9,16H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166626 ((6-Methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl)me...) Show SMILES Cc1ccc(cc1)-c1nc2ccc(C)cn2c1CN Show InChI InChI=1S/C16H17N3/c1-11-3-6-13(7-4-11)16-14(9-17)19-10-12(2)5-8-15(19)18-16/h3-8,10H,9,17H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167931 (1,5-dimethyl-2-phenyl-4-(2-(phenylsulfonyl)acetyl)...) Show SMILES Cc1c(C(=O)CS(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C Show InChI InChI=1S/C19H18N2O4S/c1-14-18(17(22)13-26(24,25)16-11-7-4-8-12-16)19(23)21(20(14)2)15-9-5-3-6-10-15/h3-12H,13H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166619 ((2-Phenylimidazo[1,2-a]pyridin-3-yl)methanamine hy...) Show SMILES NCc1c(nc2ccccn12)-c1ccccc1 Show InChI InChI=1S/C14H13N3/c15-10-12-14(11-6-2-1-3-7-11)16-13-8-4-5-9-17(12)13/h1-9H,10,15H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167937 (4-(8,10-Dimethyl-3-(phenylsulfonyl)pyrido[2',3...) Show SMILES Cc1c(-c2c(cnc3c4c(C)cc(C)nc4nn23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(-1.25,12.4,;.29,12.4,;1.19,11.15,;.72,9.69,;1.75,8.55,;1.27,7.08,;-.23,6.76,;-1.27,7.91,;-2.81,7.91,;-3.84,6.76,;-3.36,5.3,;-5.34,7.08,;-5.82,8.55,;-7.32,8.87,;-4.79,9.69,;-3.28,9.37,;-2.04,10.28,;-.79,9.37,;3.25,8.87,;3.61,7.37,;2.89,10.36,;4.74,9.26,;5.83,8.18,;7.32,8.57,;7.72,10.06,;6.63,11.15,;5.14,10.75,;2.66,11.63,;3.9,10.73,;2.66,13.17,;3.9,14.08,;5.31,13.45,;6.56,14.35,;6.4,15.89,;4.99,16.51,;3.74,15.61,;1.19,13.65,;.72,15.11,)| Show InChI InChI=1S/C28H24N6O3S/c1-17-15-18(2)30-26-23(17)27-29-16-22(38(36,37)21-13-9-6-10-14-21)25(33(27)31-26)24-19(3)32(4)34(28(24)35)20-11-7-5-8-12-20/h5-16H,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.45E+4	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167940 (6-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1Hpyraz...) Show SMILES Cc1c(-c2[nH]c(=O)c(cc2S(=O)(=O)c2ccccc2)C#N)c(=O)n(-c2ccccc2)n1C |(-1.38,-2.74,;.09,-3.22,;.56,-4.68,;-.34,-5.93,;.28,-7.33,;-.62,-8.58,;.01,-9.99,;-2.15,-8.42,;-2.78,-7.01,;-1.87,-5.76,;-2.5,-4.36,;-3.91,-4.98,;-1.09,-3.73,;-3.13,-2.95,;-4.66,-2.79,;-5.28,-1.38,;-4.38,-.14,;-2.85,-.3,;-2.22,-1.71,;-3.06,-9.66,;-3.96,-10.91,;2.1,-4.68,;3.01,-5.93,;2.58,-3.22,;4.04,-2.74,;4.36,-1.23,;5.83,-.76,;6.97,-1.79,;6.65,-3.29,;5.19,-3.77,;1.33,-2.31,;1.33,-.77,)| Show InChI InChI=1S/C23H18N4O4S/c1-15-20(23(29)27(26(15)2)17-9-5-3-6-10-17)21-19(13-16(14-24)22(28)25-21)32(30,31)18-11-7-4-8-12-18/h3-13H,1-2H3,(H,25,28)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.73E+4	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167941 (Ethyl 6-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1...) Show SMILES CCOC(=O)c1cc(c(nc1C)-c1c(C)n(C)n(-c2ccccc2)c1=O)S(=O)(=O)c1ccccc1 |(-2.71,-13.72,;-3.34,-12.32,;-2.43,-11.07,;-3.06,-9.66,;-4.59,-9.5,;-2.15,-8.42,;-2.78,-7.01,;-1.87,-5.76,;-.34,-5.93,;.28,-7.33,;-.62,-8.58,;.01,-9.99,;.56,-4.68,;.09,-3.22,;-1.38,-2.74,;1.33,-2.31,;1.33,-.77,;2.58,-3.22,;4.04,-2.74,;4.36,-1.23,;5.83,-.76,;6.97,-1.79,;6.65,-3.29,;5.19,-3.77,;2.1,-4.68,;3.01,-5.93,;-2.5,-4.36,;-1.09,-3.73,;-3.13,-2.95,;-3.91,-4.98,;-4.07,-6.52,;-5.47,-7.14,;-6.72,-6.24,;-6.56,-4.71,;-5.15,-4.08,)| Show InChI InChI=1S/C26H25N3O5S/c1-5-34-26(31)21-16-22(35(32,33)20-14-10-7-11-15-20)24(27-17(21)2)23-18(3)28(4)29(25(23)30)19-12-8-6-9-13-19/h6-16H,5H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76E+4	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM167942 (Ethyl 6-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1...) Show SMILES CCOC(=O)c1cc(c(nc1-c1ccccc1)-c1c(C)n(C)n(-c2ccccc2)c1=O)S(=O)(=O)c1ccccc1 |(-2.71,-13.72,;-3.34,-12.32,;-2.43,-11.07,;-3.06,-9.66,;-4.59,-9.5,;-2.15,-8.42,;-2.78,-7.01,;-1.87,-5.76,;-.34,-5.93,;.28,-7.33,;-.62,-8.58,;.01,-9.99,;1.54,-10.15,;2.16,-11.55,;1.26,-12.8,;-.27,-12.64,;-.9,-11.23,;.56,-4.68,;.09,-3.22,;-1.38,-2.74,;1.33,-2.31,;1.33,-.77,;2.58,-3.22,;4.04,-2.74,;4.36,-1.23,;5.83,-.76,;6.97,-1.79,;6.65,-3.29,;5.19,-3.77,;2.1,-4.68,;3.01,-5.93,;-2.5,-4.36,;-1.09,-3.73,;-3.13,-2.95,;-3.91,-4.98,;-4.07,-6.52,;-5.47,-7.14,;-6.72,-6.24,;-6.56,-4.71,;-5.15,-4.08,)| Show InChI InChI=1S/C31H27N3O5S/c1-4-39-31(36)25-20-26(40(37,38)24-18-12-7-13-19-24)29(32-28(25)22-14-8-5-9-15-22)27-21(2)33(3)34(30(27)35)23-16-10-6-11-17-23/h5-20H,4H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.83E+4	n/a	n/a	n/a	n/a	n/a	25
Cairo University					Assay Description A 200-µL reaction system containing DPP-IV (Sigma), a test compound, and 25 mmol/L HEPES buffer (containing 140 mmol/L NaCl, 1% BSA, and 80 mmol/L Mg...				Chem Biol Drug Des 86: 1292-303 (2015) Article DOI: 10.1111/cbdd.12593 BindingDB Entry DOI: 10.7270/Q2M32THN
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166628 ((8-Methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl)me...) Show SMILES Cc1ccc(cc1)-c1nc2c(C)cccn2c1CN Show InChI InChI=1S/C16H17N3/c1-11-5-7-13(8-6-11)15-14(10-17)19-9-3-4-12(2)16(19)18-15/h3-9H,10,17H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166620 ((2-(3-Chlorophenyl)imidazo[1,2-a]pyridin-3-yl)meth...) Show SMILES NCc1c(nc2ccccn12)-c1cccc(Cl)c1 Show InChI InChI=1S/C14H12ClN3/c15-11-5-3-4-10(8-11)14-12(9-16)18-7-2-1-6-13(18)17-14/h1-8H,9,16H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 [K6R,T557I] (Homo sapiens (Human))	BDBM166629 (Methyl 3-(aminomethyl)-2-(p-tolyl)imidazo[1,2-a]py...) Show SMILES COC(=O)c1ccc2nc(c(CN)n2c1)-c1ccc(C)cc1 Show InChI InChI=1S/C17H17N3O2/c1-11-3-5-12(6-4-11)16-14(9-18)20-10-13(17(21)22-2)7-8-15(20)19-16/h3-8,10H,9,18H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University					Assay Description The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...				Chem Biol Drug Des 86: 849-56 (2015) Article DOI: 10.1111/cbdd.12560 BindingDB Entry DOI: 10.7270/Q2FJ2FJG
					More data for this Ligand-Target Pair