Compile Data Set for Download or QSAR

Found 40 hits of ki for UniProtKB: P22411   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50287059 ((S)-1-(2-Amino-3-methyl-pentanoyl)-pyrrolidine-2-c...) Show SMILES CCC(C)C(N)C(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C11H19N3O/c1-3-8(2)10(13)11(15)14-6-4-5-9(14)7-12/h8-10H,3-6,13H2,1-2H3/t8?,9-,10?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11928 ((1S,3S,5S)-2-{[(2S,4S)-4-[(3-chloro-4-cyanophenyl)...) Show SMILES Clc1cc(N[C@@H]2CN[C@@H](C2)C(=O)N2[C@H]3C[C@H]3C[C@H]2C#N)ccc1C#N |r| Show InChI InChI=1S/C18H18ClN5O/c19-15-5-12(2-1-10(15)7-20)23-13-6-16(22-9-13)18(25)24-14(8-21)3-11-4-17(11)24/h1-2,5,11,13-14,16-17,22-23H,3-4,6,9H2/t11-,13+,14+,16+,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.60	-11.4	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145999 ((1S,5S)-2-(2-Amino-2-cyclopentyl-acetyl)-2-aza-bic...) Show SMILES NC(C1CCCC1)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C13H19N3O/c14-7-10-5-9-6-11(9)16(10)13(17)12(15)8-3-1-2-4-8/h8-12H,1-6,15H2/t9-,10?,11+,12?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146002 ((S)-2-((S)-2-Amino-3-methyl-3-(S)-methyl-butyryl)-...) Show SMILES CC(C)(C)[C@H](N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C12H19N3O/c1-12(2,3)10(14)11(16)15-8(6-13)4-7-5-9(7)15/h7-10H,4-5,14H2,1-3H3/t7-,8?,9+,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146015 ((1S,5S)-2-[2-Amino-2-(1-methyl-cyclopentyl)-acetyl...) Show SMILES CC1(CCCC1)C(N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C14H21N3O/c1-14(4-2-3-5-14)12(16)13(18)17-10(8-15)6-9-7-11(9)17/h9-12H,2-7,16H2,1H3/t9-,10?,11+,12?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146009 ((1S,5S)-2-[2-Amino-2-(1-methyl-cyclohexyl)-acetyl]...) Show SMILES CC1(CCCCC1)C(N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C15H23N3O/c1-15(5-3-2-4-6-15)13(17)14(19)18-11(9-16)7-10-8-12(10)18/h10-13H,2-8,17H2,1H3/t10-,11?,12+,13?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50151003 ((S)-1-((S)-2-Amino-3,3-dimethyl-butyryl)-pyrrolidi...) Show SMILES CC(C)(C)[C@H](N)C(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C11H19N3O/c1-11(2,3)9(13)10(15)14-6-4-5-8(14)7-12/h8-9H,4-6,13H2,1-3H3/t8-,9+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146010 ((1S,5S)-2-[2-Amino-2-(1-methyl-cyclobutyl)-acetyl]...) Show SMILES CC1(CCC1)C(N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C13H19N3O/c1-13(3-2-4-13)11(15)12(17)16-9(7-14)5-8-6-10(8)16/h8-11H,2-6,15H2,1H3/t8-,9?,10+,11?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145997 ((1S,5S)-2-(2-Amino-2-cyclobutyl-acetyl)-2-aza-bicy...) Show SMILES NC(C1CCC1)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C12H17N3O/c13-6-9-4-8-5-10(8)15(9)12(16)11(14)7-2-1-3-7/h7-11H,1-5,14H2/t8-,9?,10+,11?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146007 ((1R,5S)-3-((S)-2-Amino-3-methyl-butyryl)-3-aza-bic...) Show SMILES CC(C)[C@H](N)C(=O)N1C[C@H]2C[C@H]2C1C#N Show InChI InChI=1S/C11H17N3O/c1-6(2)10(13)11(15)14-5-7-3-8(7)9(14)4-12/h6-10H,3,5,13H2,1-2H3/t7-,8-,9?,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146013 ((1R,5S)-3-((S)-2-Amino-3,3-dimethyl-butyryl)-3-aza...) Show SMILES CC(C)(C)[C@H](N)C(=O)N1C[C@H]2C[C@H]2C1C#N Show InChI InChI=1S/C12H19N3O/c1-12(2,3)10(14)11(16)15-6-7-4-8(7)9(15)5-13/h7-10H,4,6,14H2,1-3H3/t7-,8-,9?,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145996 ((1R,5S)-3-((S)-2-Amino-3-methyl-pentanoyl)-3-aza-b...) Show SMILES CCC(C)[C@H](N)C(=O)N1C[C@H]2C[C@H]2C1C#N Show InChI InChI=1S/C12H19N3O/c1-3-7(2)11(14)12(16)15-6-8-4-9(8)10(15)5-13/h7-11H,3-4,6,14H2,1-2H3/t7?,8-,9-,10?,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146005 ((1S,5S)-2-(2-Amino-2-cyclohexyl-acetyl)-2-aza-bicy...) Show SMILES NC(C1CCCCC1)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C14H21N3O/c15-8-11-6-10-7-12(10)17(11)14(18)13(16)9-4-2-1-3-5-9/h9-13H,1-7,16H2/t10-,11?,12+,13?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146000 ((1S,5S)-2-((S)-2-Amino-3-methyl-pentanoyl)-2-aza-b...) Show SMILES CCC(C)[C@H](N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C12H19N3O/c1-3-7(2)11(14)12(16)15-9(6-13)4-8-5-10(8)15/h7-11H,3-5,14H2,1-2H3/t7?,8-,9?,10+,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146004 ((1R,5R)-2-((S)-2-Amino-3-methyl-butyryl)-2-aza-bic...) Show SMILES CC(C)[C@H](N)C(=O)N1[C@@H]2C[C@@H]2CC1C#N Show InChI InChI=1S/C11H17N3O/c1-6(2)10(13)11(15)14-8(5-12)3-7-4-9(7)14/h6-10H,3-4,13H2,1-2H3/t7-,8?,9+,10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11920 ((1S,3S,5S)-2-{[(2S)-3,3-dimethylpyrrolidin-2-yl]ca...) Show SMILES CC1(C)CCN[C@@H]1C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C13H19N3O/c1-13(2)3-4-15-11(13)12(17)16-9(7-14)5-8-6-10(8)16/h8-11,15H,3-6H2,1-2H3/t8-,9+,10+,11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	37	-10.0	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11927 (4-chloro-N-[(3S,5S)-5-{[(1S,3S,5S)-3-cyano-2-azabi...) Show SMILES Clc1ccc(cc1)S(=O)(=O)N[C@@H]1CN[C@@H](C1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C17H19ClN4O3S/c18-11-1-3-14(4-2-11)26(24,25)21-12-7-15(20-9-12)17(23)22-13(8-19)5-10-6-16(10)22/h1-4,10,12-13,15-16,20-21H,5-7,9H2/t10-,12+,13+,15+,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	39	-10.0	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50206821 ((R)-3-amino-1-(2-benzoylpiperazin-1-yl)-4-(2,4,5-t...) Show SMILES N[C@@H](CC(=O)N1CCCCN1C(=O)c1ccccc1)Cc1cc(F)c(F)cc1F Show InChI InChI=1S/C21H22F3N3O2/c22-17-13-19(24)18(23)11-15(17)10-16(25)12-20(28)26-8-4-5-9-27(26)21(29)14-6-2-1-3-7-14/h1-3,6-7,11,13,16H,4-5,8-10,12,25H2/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of pig kidney DPP4				Bioorg Med Chem Lett 17: 2622-8 (2007) Article DOI: 10.1016/j.bmcl.2007.01.111 BindingDB Entry DOI: 10.7270/Q21V5FS4
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11917 ((1S,3S,5S)-2-[(1S,2S,5R)-3-azabicyclo[3.1.0]hexan-...) Show SMILES O=C([C@H]1NC[C@@H]2C[C@H]12)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C12H15N3O/c13-4-8-1-6-3-10(6)15(8)12(16)11-9-2-7(9)5-14-11/h6-11,14H,1-3,5H2/t6-,7+,8+,9+,10+,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	52	-9.83	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50206820 ((R)-3-amino-1-(2-benzoyl-1,2-diazepan-1-yl)-4-(2,4...) Show SMILES N[C@@H](CC(=O)N1CCCCCN1C(=O)c1ccccc1)Cc1cc(F)c(F)cc1F Show InChI InChI=1S/C22H24F3N3O2/c23-18-14-20(25)19(24)12-16(18)11-17(26)13-21(29)27-9-5-2-6-10-28(27)22(30)15-7-3-1-4-8-15/h1,3-4,7-8,12,14,17H,2,5-6,9-11,13,26H2/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL DrugBank PC cid PC sid PDB UniChem Similars	PDB Article PubMed	56.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of pig kidney DPP4				Bioorg Med Chem Lett 17: 2622-8 (2007) Article DOI: 10.1016/j.bmcl.2007.01.111 BindingDB Entry DOI: 10.7270/Q21V5FS4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11925 (9H-fluoren-9-ylmethyl N-[(3S,5S)-5-{[(1S,3S,5S)-3-...) Show SMILES O=C(N[C@@H]1CN[C@@H](C1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N)OCC1c2ccccc2-c2ccccc12 |r| Show InChI InChI=1S/C26H26N4O3/c27-12-17-9-15-10-24(15)30(17)25(31)23-11-16(13-28-23)29-26(32)33-14-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-8,15-17,22-24,28H,9-11,13-14H2,(H,29,32)/t15-,16+,17+,23+,24+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	57	-9.78	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146006 ((1S,5S)-2-((S)-2-Amino-3-phenyl-propionyl)-2-aza-b...) Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C15H17N3O/c16-9-12-7-11-8-14(11)18(12)15(19)13(17)6-10-4-2-1-3-5-10/h1-5,11-14H,6-8,17H2/t11-,12?,13+,14+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146001 ((1S,5S)-2-((S)-1-Amino-pyrrolidine-2-carbonyl)-2-a...) Show SMILES NN1CCC[C@H]1C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C11H16N4O/c12-6-8-4-7-5-10(7)15(8)11(16)9-2-1-3-14(9)13/h7-10H,1-5,13H2/t7-,8?,9+,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	107	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11919 ((1S,3S,5S)-2-{[(2S,3S)-3-methylpyrrolidin-2-yl]car...) Show SMILES C[C@H]1CCN[C@@H]1C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C12H17N3O/c1-7-2-3-14-11(7)12(16)15-9(6-13)4-8-5-10(8)15/h7-11,14H,2-5H2,1H3/t7-,8+,9-,10-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	126	-9.31	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11926 (N-[(3S,5S)-5-{[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1...) Show SMILES CC(C)(C)CC(=O)N[C@@H]1CN[C@@H](C1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C17H26N4O2/c1-17(2,3)7-15(22)20-11-6-13(19-9-11)16(23)21-12(8-18)4-10-5-14(10)21/h10-14,19H,4-7,9H2,1-3H3,(H,20,22)/t10-,11+,12+,13+,14+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	133	-9.28	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146012 ((1S,5S)-2-((S)-2-Amino-4-methylsulfanyl-butyryl)-2...) Show SMILES CSCC[C@H](N)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C11H17N3OS/c1-16-3-2-9(13)11(15)14-8(6-12)4-7-5-10(7)14/h7-10H,2-5,13H2,1H3/t7-,8?,9+,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	135	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11923 (substituted diprolyl nitrile 16 | tert-butyl N-[(3...) Show SMILES CC(C)(C)OC(=O)N[C@@H]1CN[C@@H](C1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C16H24N4O3/c1-16(2,3)23-15(22)19-10-6-12(18-8-10)14(21)20-11(7-17)4-9-5-13(9)20/h9-13,18H,4-6,8H2,1-3H3,(H,19,22)/t9-,10+,11+,12+,13+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	140	-9.25	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145998 ((1S,5S)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propionyl...) Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C17H18N4O/c18-8-12-5-10-7-16(10)21(12)17(22)14(19)6-11-9-20-15-4-2-1-3-13(11)15/h1-4,9-10,12,14,16,20H,5-7,19H2/t10-,12?,14+,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11921 ((1S,3S,5S)-2-{[(2S,3S)-3-ethylpyrrolidin-2-yl]carb...) Show SMILES CC[C@H]1CCN[C@@H]1C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C13H19N3O/c1-2-8-3-4-15-12(8)13(17)16-10(7-14)5-9-6-11(9)16/h8-12,15H,2-6H2,1H3/t8-,9+,10-,11-,12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	290	-8.82	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11914 ((1S,3S,5S)-2-[(2S)-pyrrolidin-2-ylcarbonyl]-2-azab...) Show SMILES O=C([C@@H]1CCCN1)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C11H15N3O/c12-6-8-4-7-5-10(7)14(8)11(15)9-2-1-3-13-9/h7-10,13H,1-5H2/t7-,8+,9+,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	305	-8.79	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11924 (substituted diprolyl nitrile 17 | tert-butyl N-[(3...) Show SMILES CC(C)(C)OC(=O)N[C@H]1CN[C@@H](C1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C16H24N4O3/c1-16(2,3)23-15(22)19-10-6-12(18-8-10)14(21)20-11(7-17)4-9-5-13(9)20/h9-13,18H,4-6,8H2,1-3H3,(H,19,22)/t9-,10-,11+,12+,13+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	492	-8.51	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11922 ((1S,3S,5S)-2-{[(2S,3R)-3-(propan-2-yl)pyrrolidin-2...) Show SMILES CC(C)[C@H]1CCN[C@@H]1C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C14H21N3O/c1-8(2)11-3-4-16-13(11)14(18)17-10(7-15)5-9-6-12(9)17/h8-13,16H,3-6H2,1-2H3/t9-,10+,11-,12+,13+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	695	-8.31	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145994 ((1R,5R)-2-((S)-2-Amino-3-methyl-pentanoyl)-2-aza-b...) Show SMILES CCC(C)[C@H](N)C(=O)N1[C@@H]2C[C@@H]2CC1C#N Show InChI InChI=1S/C12H19N3O/c1-3-7(2)11(14)12(16)15-9(6-13)4-8-5-10(8)15/h7-11H,3-5,14H2,1-2H3/t7?,8-,9?,10+,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.62E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50145995 ((1S,5S)-2-((S)-3-Methyl-2-methylamino-butyryl)-2-a...) Show SMILES CN[C@@H](C(C)C)C(=O)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C12H19N3O/c1-7(2)11(14-3)12(16)15-9(6-13)4-8-5-10(8)15/h7-11,14H,4-5H2,1-3H3/t8-,9?,10+,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.94E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146011 ((1S,5R)-2-((S)-2-Amino-3-methyl-pentanoyl)-2-aza-b...) Show SMILES CCC(C)[C@H](N)C(=O)N1CC[C@@H]2C[C@]12C#N Show InChI InChI=1S/C12H19N3O/c1-3-8(2)10(14)11(16)15-5-4-9-6-12(9,15)7-13/h8-10H,3-6,14H2,1-2H3/t8?,9-,10+,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11915 ((1S,3S,5S)-2-[(2R)-pyrrolidin-2-ylcarbonyl]-2-azab...) Show SMILES O=C([C@H]1CCCN1)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C11H15N3O/c12-6-8-4-7-5-10(7)14(8)11(15)9-2-1-3-13-9/h7-10,13H,1-5H2/t7-,8+,9-,10+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	>-6.75	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11916 ((1S,3S,5S)-2-[(2S)-azetidin-2-ylcarbonyl]-2-azabic...) Show SMILES O=C([C@@H]1CCN1)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C10H13N3O/c11-5-7-3-6-4-9(6)13(7)10(14)8-1-2-12-8/h6-9,12H,1-4H2/t6-,7+,8+,9+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	>-6.75	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11918 ((1S,3S,5S)-2-[(1S,3S,5S)-2-azabicyclo[3.1.0]hexan-...) Show SMILES O=C([C@@H]1C[C@@H]2C[C@@H]2N1)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C12H15N3O/c13-5-8-1-7-4-11(7)15(8)12(16)10-3-6-2-9(6)14-10/h6-11,14H,1-4H2/t6-,7+,8-,9-,10-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	>-6.75	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM11913 ((1S,3S,5S)-2-[(2S)-piperidin-2-ylcarbonyl]-2-azabi...) Show SMILES O=C([C@@H]1CCCCN1)N1[C@H]2C[C@H]2C[C@H]1C#N |r| Show InChI InChI=1S/C12H17N3O/c13-7-9-5-8-6-11(8)15(9)12(16)10-3-1-2-4-14-10/h8-11,14H,1-6H2/t8-,9+,10+,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	>-6.75	n/a	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Pharmaceutical Research Institute					Assay Description Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...				Bioorg Med Chem Lett 15: 3992-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.043 BindingDB Entry DOI: 10.7270/Q2CN7259
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Sus scrofa (pig))	BDBM50146008 ((1S,5S)-2-(Piperidine-2-carbonyl)-2-aza-bicyclo[3....) Show SMILES O=C(C1CCCCN1)N1[C@H]2C[C@H]2CC1C#N Show InChI InChI=1S/C12H17N3O/c13-7-9-5-8-6-11(8)15(9)12(16)10-3-1-2-4-14-10/h8-11,14H,1-6H2/t8-,9?,10?,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase IV.				J Med Chem 47: 2587-98 (2004) Article DOI: 10.1021/jm049924d BindingDB Entry DOI: 10.7270/Q2FT8MSQ
					More data for this Ligand-Target Pair