Compile Data Set for Download or QSAR

Found 19 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50040124   

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 9 (Homo sapiens (Human))	BDBM50389480 (CHEMBL2063040) Show SMILES [#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6@@H](-[#8])-[#6]-[#6@H]-1-[#5](-[#8])-[#8] |r| Show InChI InChI=1S/C10H22BN5O4/c12-7(2-1-3-15-10(13)14)9(18)16-5-6(17)4-8(16)11(19)20/h6-8,17,19-20H,1-5,12H2,(H4,13,14,15)/t6-,7-,8-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.310	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389473 (CHEMBL2063033) Show SMILES OB(O)[C@@H]1C[C@H](O)CN1C(=O)[C@@H]1CCCN1 |r| Show InChI InChI=1S/C9H17BN2O4/c13-6-4-8(10(15)16)12(5-6)9(14)7-2-1-3-11-7/h6-8,11,13,15-16H,1-5H2/t6-,7-,8-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50050525 ((R)-1-((S)-2-aminopropanoyl)pyrrolidin-2-ylboronic...) Show SMILES C[C@H](N)C(=O)N1CCC[C@H]1B(O)O |r| Show InChI InChI=1S/C7H15BN2O3/c1-5(9)7(11)10-4-2-3-6(10)8(12)13/h5-6,12-13H,2-4,9H2,1H3/t5-,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389465 (CHEMBL2063024) Show SMILES C[C@H](N)C(=O)N1C[C@@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C7H15BN2O4/c1-4(9)7(12)10-3-5(11)2-6(10)8(13)14/h4-6,11,13-14H,2-3,9H2,1H3/t4-,5-,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389471 (CHEMBL2063031) Show SMILES CC(C)(C)[C@H](N)C(=O)N1C[C@@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C10H21BN2O4/c1-10(2,3)8(12)9(15)13-5-6(14)4-7(13)11(16)17/h6-8,14,16-17H,4-5,12H2,1-3H3/t6-,7-,8+/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.40	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389475 (CHEMBL2063035) Show SMILES OB(O)[C@@H]1C[C@H](O)CN1C(=O)[C@@H]1C[C@@H](O)CN1 |r| Show InChI InChI=1S/C9H17BN2O5/c13-5-1-7(11-3-5)9(15)12-4-6(14)2-8(12)10(16)17/h5-8,11,13-14,16-17H,1-4H2/t5-,6+,7+,8+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389477 (CHEMBL2063037) Show SMILES OB(O)[C@@H]1C[C@H](O)CN1C(=O)[C@@H]1C[C@H](O)CN1 |r| Show InChI InChI=1S/C9H17BN2O5/c13-5-1-7(11-3-5)9(15)12-4-6(14)2-8(12)10(16)17/h5-8,11,13-14,16-17H,1-4H2/t5-,6-,7-,8-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.5	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389467 (CHEMBL2063026) Show SMILES C[C@H](N)C(=O)N1C[C@H](F)C[C@H]1B(O)O |r| Show InChI InChI=1S/C7H14BFN2O3/c1-4(10)7(12)11-3-5(9)2-6(11)8(13)14/h4-6,13-14H,2-3,10H2,1H3/t4-,5+,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389472 (CHEMBL2063032) Show SMILES CC(C)(C)[C@H](N)C(=O)N1C[C@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C10H21BN2O4/c1-10(2,3)8(12)9(15)13-5-6(14)4-7(13)11(16)17/h6-8,14,16-17H,4-5,12H2,1-3H3/t6-,7+,8-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389469 (CHEMBL2063029) Show SMILES N[C@@H](CCC(O)=O)C(=O)N1C[C@@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C9H17BN2O6/c11-6(1-2-8(14)15)9(16)12-4-5(13)3-7(12)10(17)18/h5-7,13,17-18H,1-4,11H2,(H,14,15)/t5-,6-,7-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389479 (CHEMBL2063039) Show SMILES N[C@@H](CCCC(O)=O)C(=O)N1C[C@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C10H19BN2O6/c12-7(2-1-3-9(15)16)10(17)13-5-6(14)4-8(13)11(18)19/h6-8,14,18-19H,1-5,12H2,(H,15,16)/t6-,7+,8+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389470 (CHEMBL2063030) Show SMILES N[C@@H](CCC(O)=O)C(=O)N1C[C@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C9H17BN2O6/c11-6(1-2-8(14)15)9(16)12-4-5(13)3-7(12)10(17)18/h5-7,13,17-18H,1-4,11H2,(H,14,15)/t5-,6+,7+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389474 (CHEMBL2063034) Show SMILES OB(O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCCN1 |r| Show InChI InChI=1S/C9H17BN2O4/c13-6-4-8(10(15)16)12(5-6)9(14)7-2-1-3-11-7/h6-8,11,13,15-16H,1-5H2/t6-,7+,8+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389466 (CHEMBL2063025) Show SMILES C[C@H](N)C(=O)N1C[C@H](O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C7H15BN2O4/c1-4(9)7(12)10-3-5(11)2-6(10)8(13)14/h4-6,11,13-14H,2-3,9H2,1H3/t4-,5+,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389464 (CHEMBL2063027) Show SMILES C[C@H](N)C(=O)N1CC(=O)C[C@H]1B(O)O |r| Show InChI InChI=1S/C7H13BN2O4/c1-4(9)7(12)10-3-5(11)2-6(10)8(13)14/h4,6,13-14H,2-3,9H2,1H3/t4-,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389476 (CHEMBL2063036) Show SMILES OB(O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1C[C@@H](O)CN1 |r| Show InChI InChI=1S/C9H17BN2O5/c13-5-1-7(11-3-5)9(15)12-4-6(14)2-8(12)10(16)17/h5-8,11,13-14,16-17H,1-4H2/t5-,6-,7+,8+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia 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
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389478 (CHEMBL2063038) Show SMILES OB(O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1C[C@H](O)CN1 |r| Show InChI InChI=1S/C9H17BN2O5/c13-5-1-7(11-3-5)9(15)12-4-6(14)2-8(12)10(16)17/h5-8,11,13-14,16-17H,1-4H2/t5-,6+,7-,8-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50389468 (CHEMBL2063028) Show SMILES C[C@H](N)C(=O)N1C[C@@H](Cl)C[C@H]1B(O)O |r| Show InChI InChI=1S/C7H14BClN2O3/c1-4(10)7(12)11-3-5(9)2-6(11)8(13)14/h4-6,13-14H,2-3,10H2,1H3/t4-,5-,6-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (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 KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tufts University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP9 expressed in HEK293 cells using Ala-Pro-p-nitroanilide hydrochloride salt as substrate preincubated for 10 mins prior to add...				Bioorg Med Chem Lett 22: 5536-40 (2012) Article DOI: 10.1016/j.bmcl.2012.07.033 BindingDB Entry DOI: 10.7270/Q2M909QF
					More data for this Ligand-Target Pair