Compile Data Set for Download or QSAR

Found 141 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 3131   

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
Plasma kallikrein (Homo sapiens (Human))	BDBM392515 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1ccn(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C22H21ClN6O/c1-13-7-21(24)27-14(2)18(13)11-26-22(30)20-5-6-29(28-20)12-15-3-4-19-16(8-15)9-17(23)10-25-19/h3-10H,11-12H2,1-2H3,(H2,24,27)(H,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392516 (N-((6-amino-2,4-dimethylpyridin-3-yl)methyl)-1-((3...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cnn(Cc2ccc3ncc(Cl)cc3c2)c1 Show InChI InChI=1S/C22H21ClN6O/c1-13-5-21(24)28-14(2)19(13)10-26-22(30)17-8-27-29(12-17)11-15-3-4-20-16(6-15)7-18(23)9-25-20/h3-9,12H,10-11H2,1-2H3,(H2,24,28)(H,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392517 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)cn1 Show InChI InChI=1S/C22H21ClN6O/c1-13-5-21(24)28-14(2)18(13)9-26-22(30)20-11-29(12-27-20)10-15-3-4-19-16(6-15)7-17(23)8-25-19/h3-8,11-12H,9-10H2,1-2H3,(H2,24,28)(H,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392518 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1ncn(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C21H20ClN7O/c1-12-5-19(23)27-13(2)17(12)9-25-21(30)20-26-11-29(28-20)10-14-3-4-18-15(6-14)7-16(22)8-24-18/h3-8,11H,9-10H2,1-2H3,(H2,23,27)(H,25,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392519 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-2-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cnc(Cc2ccc3ncc(Cl)cc3c2)[nH]1 Show InChI InChI=1S/C22H21ClN6O/c1-12-5-20(24)28-13(2)17(12)10-27-22(30)19-11-26-21(29-19)7-14-3-4-18-15(6-14)8-16(23)9-25-18/h3-6,8-9,11H,7,10H2,1-2H3,(H2,24,28)(H,26,29)(H,27,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392520 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nc(Cc2ccc3ncc(Cl)cc3c2)no1 Show InChI InChI=1S/C21H19ClN6O2/c1-11-5-18(23)26-12(2)16(11)10-25-20(29)21-27-19(28-30-21)7-13-3-4-17-14(6-13)8-15(22)9-24-17/h3-6,8-9H,7,10H2,1-2H3,(H2,23,26)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392521 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-5-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1noc(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C21H19ClN6O2/c1-11-5-18(23)26-12(2)16(11)10-25-21(29)20-27-19(30-28-20)7-13-3-4-17-14(6-13)8-15(22)9-24-17/h3-6,8-9H,7,10H2,1-2H3,(H2,23,26)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392522 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2cccnc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-8-24(28)32-16(2)20(15)12-31-26(34)21-14-33(23-4-3-7-29-25(21)23)13-17-5-6-22-18(9-17)10-19(27)11-30-22/h3-11,14H,12-13H2,1-2H3,(H2,28,32)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392523 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nc(Cc2ccc3ncc(Cl)cc3c2)n2ccccc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-9-23(28)31-16(2)20(15)14-30-26(34)25-22-5-3-4-8-33(22)24(32-25)11-17-6-7-21-18(10-17)12-19(27)13-29-21/h3-10,12-13H,11,14H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392524 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nn1 Show InChI InChI=1S/C21H20ClN7O/c1-12-5-20(23)26-13(2)17(12)9-25-21(30)19-11-29(28-27-19)10-14-3-4-18-15(6-14)7-16(22)8-24-18/h3-8,11H,9-10H2,1-2H3,(H2,23,26)(H,25,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392525 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2ccccc12 Show InChI InChI=1S/C27H24ClN5O/c1-16-9-26(29)32-17(2)22(16)13-31-27(34)23-15-33(25-6-4-3-5-21(23)25)14-18-7-8-24-19(10-18)11-20(28)12-30-24/h3-12,15H,13-14H2,1-2H3,(H2,29,32)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392526 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2ncccc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-8-24(28)32-16(2)21(15)12-31-26(34)22-14-33(25-20(22)4-3-7-29-25)13-17-5-6-23-18(9-17)10-19(27)11-30-23/h3-11,14H,12-13H2,1-2H3,(H2,28,32)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392527 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nn(Cc2ccc3ncc(Cl)cc3c2)c2ccccc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-9-24(28)31-16(2)21(15)13-30-26(34)25-20-5-3-4-6-23(20)33(32-25)14-17-7-8-22-18(10-17)11-19(27)12-29-22/h3-12H,13-14H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392529 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nc1C(F)(F)F Show InChI InChI=1S/C23H20ClF3N6O/c1-12-5-20(28)31-13(2)17(12)9-30-22(34)18-11-33(32-21(18)23(25,26)27)10-14-3-4-19-15(6-14)7-16(24)8-29-19/h3-8,11H,9-10H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392530 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2cnccc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-7-25(28)32-16(2)21(15)11-31-26(34)22-14-33(24-12-29-6-5-20(22)24)13-17-3-4-23-18(8-17)9-19(27)10-30-23/h3-10,12,14H,11,13H2,1-2H3,(H2,28,32)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392531 (3-amino-N-((6-amino-2,4- dimethylpyridin-3-yl)meth...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nc1N Show InChI InChI=1S/C22H22ClN7O/c1-12-5-20(24)28-13(2)17(12)9-27-22(31)18-11-30(29-21(18)25)10-14-3-4-19-15(6-14)7-16(23)8-26-19/h3-8,11H,9-10H2,1-2H3,(H2,24,28)(H2,25,29)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392532 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nn(Cc2ccc3ncc(Cl)cc3c2)cc1[N+]([O-])=O Show InChI InChI=1S/C22H20ClN7O3/c1-12-5-20(24)27-13(2)17(12)9-26-22(31)21-19(30(32)33)11-29(28-21)10-14-3-4-18-15(6-14)7-16(23)8-25-18/h3-8,11H,9-10H2,1-2H3,(H2,24,27)(H,26,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392533 (4-acetamido-N-((6-amino-2,4- dimethylpyridin-3-yl)...) Show SMILES CC(=O)Nc1cn(Cc2ccc3ncc(Cl)cc3c2)nc1C(=O)NCc1c(C)cc(N)nc1C Show InChI InChI=1S/C24H24ClN7O2/c1-13-6-22(26)29-14(2)19(13)10-28-24(34)23-21(30-15(3)33)12-32(31-23)11-16-4-5-20-17(7-16)8-18(25)9-27-20/h4-9,12H,10-11H2,1-3H3,(H2,26,29)(H,28,34)(H,30,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392534 (5-amino-N-((6-amino-2,4- dimethylpyridin-3-yl)meth...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nc(N)n(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C21H21ClN8O/c1-11-5-18(23)27-12(2)16(11)9-26-20(31)19-28-21(24)30(29-19)10-13-3-4-17-14(6-13)7-15(22)8-25-17/h3-8H,9-10H2,1-2H3,(H2,23,27)(H,26,31)(H2,24,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392535 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-2-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cnn(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C21H20ClN7O/c1-12-5-20(23)27-13(2)17(12)9-25-21(30)19-10-26-29(28-19)11-14-3-4-18-15(6-14)7-16(22)8-24-18/h3-8,10H,9,11H2,1-2H3,(H2,23,27)(H,25,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392536 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nn(Cc2ccc3ncc(Cl)cc3c2)cc1C(F)(F)F Show InChI InChI=1S/C23H20ClF3N6O/c1-12-5-20(28)31-13(2)17(12)9-30-22(34)21-18(23(25,26)27)11-33(32-21)10-14-3-4-19-15(6-14)7-16(24)8-29-19/h3-8,11H,9-10H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392537 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nc(Cc2ccc3ncc(Cl)cc3c2)c2ccccn12 Show InChI InChI=1S/C26H23ClN6O/c1-15-9-24(28)31-16(2)20(15)14-30-26(34)25-32-22(23-5-3-4-8-33(23)25)11-17-6-7-21-18(10-17)12-19(27)13-29-21/h3-10,12-13H,11,14H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392538 (4-amino-N-((6-amino-2,4- dimethylpyridin-3-yl)meth...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nn(Cc2ccc3ncc(Cl)cc3c2)cc1N Show InChI InChI=1S/C22H22ClN7O/c1-12-5-20(25)28-13(2)17(12)9-27-22(31)21-18(24)11-30(29-21)10-14-3-4-19-15(6-14)7-16(23)8-26-19/h3-8,11H,9-10,24H2,1-2H3,(H2,25,28)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392539 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nc1C#N Show InChI InChI=1S/C23H20ClN7O/c1-13-5-22(26)29-14(2)18(13)10-28-23(32)19-12-31(30-21(19)8-25)11-15-3-4-20-16(6-15)7-17(24)9-27-20/h3-7,9,12H,10-11H2,1-2H3,(H2,26,29)(H,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392540 (N4-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-(...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nc1C(N)=O Show InChI InChI=1S/C23H22ClN7O2/c1-12-5-20(25)29-13(2)17(12)9-28-23(33)18-11-31(30-21(18)22(26)32)10-14-3-4-19-15(6-14)7-16(24)8-27-19/h3-8,11H,9-10H2,1-2H3,(H2,25,29)(H2,26,32)(H,28,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392541 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-(a...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)nc1CN Show InChI InChI=1S/C23H24ClN7O/c1-13-5-22(26)29-14(2)18(13)10-28-23(32)19-12-31(30-21(19)8-25)11-15-3-4-20-16(6-15)7-17(24)9-27-20/h3-7,9,12H,8,10-11,25H2,1-2H3,(H2,26,29)(H,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392542 (2-amino-N-((6-amino-2,4- dimethylpyridin-3-yl)meth...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c(N)n1 Show InChI InChI=1S/C22H22ClN7O/c1-12-5-20(24)28-13(2)17(12)9-27-21(31)19-11-30(22(25)29-19)10-14-3-4-18-15(6-14)7-16(23)8-26-18/h3-8,11H,9-10H2,1-2H3,(H2,24,28)(H2,25,29)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392543 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-2-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1coc(Cc2ccc3ncc(Cl)cc3c2)n1 Show InChI InChI=1S/C22H20ClN5O2/c1-12-5-20(24)27-13(2)17(12)10-26-22(29)19-11-30-21(28-19)7-14-3-4-18-15(6-14)8-16(23)9-25-18/h3-6,8-9,11H,7,10H2,1-2H3,(H2,24,27)(H,26,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392544 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-5-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nnc(Cc2ccc3ncc(Cl)cc3c2)o1 Show InChI InChI=1S/C21H19ClN6O2/c1-11-5-18(23)26-12(2)16(11)10-25-20(29)21-28-27-19(30-21)7-13-3-4-17-14(6-13)8-15(22)9-24-17/h3-6,8-9H,7,10H2,1-2H3,(H2,23,26)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392545 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-5-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1ncc(Cc2ccc3ncc(Cl)cc3c2)o1 Show InChI InChI=1S/C22H20ClN5O2/c1-12-5-20(24)28-13(2)18(12)11-26-21(29)22-27-10-17(30-22)7-14-3-4-19-15(6-14)8-16(23)9-25-19/h3-6,8-10H,7,11H2,1-2H3,(H2,24,28)(H,26,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392546 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-7-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2ncncc12 Show InChI InChI=1S/C25H22ClN7O/c1-14-5-23(27)32-15(2)19(14)10-30-25(34)21-12-33(24-20(21)9-28-13-31-24)11-16-3-4-22-17(6-16)7-18(26)8-29-22/h3-9,12-13H,10-11H2,1-2H3,(H2,27,32)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392548 (4-amino-N-((6-amino-2,4- dimethylpyridin-3-yl)meth...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2ncnc(N)c12 Show InChI InChI=1S/C25H23ClN8O/c1-13-5-21(27)33-14(2)18(13)9-30-25(35)19-11-34(24-22(19)23(28)31-12-32-24)10-15-3-4-20-16(6-15)7-17(26)8-29-20/h3-8,11-12H,9-10H2,1-2H3,(H2,27,33)(H,30,35)(H2,28,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392549 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(Cl)cc3c2)c2ccncc12 Show InChI InChI=1S/C26H23ClN6O/c1-15-7-25(28)32-16(2)20(15)12-31-26(34)22-14-33(24-5-6-29-11-21(22)24)13-17-3-4-23-18(8-17)9-19(27)10-30-23/h3-11,14H,12-13H2,1-2H3,(H2,28,32)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392550 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1nn(Cc2ccc3ncc(Cl)cc3c2)cc1C#N Show InChI InChI=1S/C23H20ClN7O/c1-13-5-21(26)29-14(2)19(13)10-28-23(32)22-17(8-25)12-31(30-22)11-15-3-4-20-16(6-15)7-18(24)9-27-20/h3-7,9,12H,10-11H2,1-2H3,(H2,26,29)(H,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392551 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-2-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1oc(Cc2ccc3ncc(Cl)cc3c2)nc1C(F)(F)F Show InChI InChI=1S/C23H19ClF3N5O2/c1-11-5-18(28)31-12(2)16(11)10-30-22(33)20-21(23(25,26)27)32-19(34-20)7-13-3-4-17-14(6-13)8-15(24)9-29-17/h3-6,8-9H,7,10H2,1-2H3,(H2,28,31)(H,30,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392552 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1nn(Cc2ccc3ncc(Cl)cc3c2)cc1C(=O)NCc1c(C)cc(N)nc1C Show InChI InChI=1S/C23H23ClN6O/c1-13-6-22(25)28-14(2)19(13)10-27-23(31)20-12-30(29-15(20)3)11-16-4-5-21-17(7-16)8-18(24)9-26-21/h4-9,12H,10-11H2,1-3H3,(H2,25,28)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392553 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES COc1nn(Cc2ccc3ncc(Cl)cc3c2)cc1C(=O)NCc1c(C)cc(N)nc1C Show InChI InChI=1S/C23H23ClN6O2/c1-13-6-21(25)28-14(2)18(13)10-27-22(31)19-12-30(29-23(19)32-3)11-15-4-5-20-16(7-15)8-17(24)9-26-20/h4-9,12H,10-11H2,1-3H3,(H2,25,28)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392563 (N-((1-aminoisoquinolin-6-yl)methyl)- 1-((3-chloroq...) Show SMILES Nc1nccc2cc(CNC(=O)c3cn(Cc4ccc5ncc(Cl)cc5c4)nc3C#N)ccc12 Show InChI InChI=1S/C25H18ClN7O/c26-19-9-18-8-16(2-4-22(18)30-12-19)13-33-14-21(23(10-27)32-33)25(34)31-11-15-1-3-20-17(7-15)5-6-29-24(20)28/h1-9,12,14H,11,13H2,(H2,28,29)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392566 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2cc(F)c3ncc(Cl)cc3c2)nc1C#N Show InChI InChI=1S/C23H19ClFN7O/c1-12-3-21(27)30-13(2)17(12)9-29-23(33)18-11-32(31-20(18)7-26)10-14-4-15-6-16(24)8-28-22(15)19(25)5-14/h3-6,8,11H,9-10H2,1-2H3,(H2,27,30)(H,29,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392567 (N-((3-chloro-6-fluoro-1H-indol-5- yl)methyl)-1-((3...) Show SMILES Fc1cc2[nH]cc(Cl)c2cc1CNC(=O)c1cn(Cc2cc(F)c3ncc(Cl)cc3c2)nc1C#N Show InChI InChI=1S/C24H14Cl2F2N6O/c25-15-3-13-1-12(2-20(28)23(13)31-8-15)10-34-11-17(22(6-29)33-34)24(35)32-7-14-4-16-18(26)9-30-21(16)5-19(14)27/h1-5,8-9,11,30H,7,10H2,(H,32,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392568 (N-((1-aminoisoquinolin-6-yl)methyl)- 1-((3-chloro-...) Show SMILES Nc1nccc2cc(CNC(=O)c3cn(Cc4cc(F)c5ncc(Cl)cc5c4)nc3C#N)ccc12 Show InChI InChI=1S/C25H17ClFN7O/c26-18-8-17-6-15(7-21(27)23(17)31-11-18)12-34-13-20(22(9-28)33-34)25(35)32-10-14-1-2-19-16(5-14)3-4-30-24(19)29/h1-8,11,13H,10,12H2,(H2,29,30)(H,32,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392570 (N-((3-chloro-1H-pyrrolo[2,3- b]pyridin-5-yl)methyl...) Show SMILES Fc1cc(Cn2cc(C(=O)NCc3cnc4[nH]cc(Cl)c4c3)c(n2)C#N)cc2cc(Cl)cnc12 Show InChI InChI=1S/C23H14Cl2FN7O/c24-15-4-14-1-12(3-19(26)21(14)28-8-15)10-33-11-17(20(5-27)32-33)23(34)31-7-13-2-16-18(25)9-30-22(16)29-6-13/h1-4,6,8-9,11H,7,10H2,(H,29,30)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392572 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2cc(c3ncc(Cl)cc3c2)C(C)(C)O)nc1C#N Show InChI InChI=1S/C26H26ClN7O2/c1-14-5-23(29)32-15(2)19(14)11-31-25(35)20-13-34(33-22(20)9-28)12-16-6-17-8-18(27)10-30-24(17)21(7-16)26(3,4)36/h5-8,10,13,36H,11-12H2,1-4H3,(H2,29,32)(H,31,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392573 (N-((1-aminoisoquinolin-6-yl)methyl)- 1-((3-chloro-...) Show SMILES CC(C)(O)c1cc(Cn2cc(C(=O)NCc3ccc4c(N)nccc4c3)c(n2)C#N)cc2cc(Cl)cnc12 Show InChI InChI=1S/C28H24ClN7O2/c1-28(2,38)23-9-17(8-19-10-20(29)13-33-25(19)23)14-36-15-22(24(11-30)35-36)27(37)34-12-16-3-4-21-18(7-16)5-6-32-26(21)31/h3-10,13,15,38H,12,14H2,1-2H3,(H2,31,32)(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392574 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2cc(c3ncc(Cl)cc3c2)S(N)(=O)=O)nc1C#N Show InChI InChI=1S/C23H21ClN8O3S/c1-12-3-21(26)30-13(2)17(12)9-29-23(33)18-11-32(31-19(18)7-25)10-14-4-15-6-16(24)8-28-22(15)20(5-14)36(27,34)35/h3-6,8,11H,9-10H2,1-2H3,(H2,26,30)(H,29,33)(H2,27,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392575 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-cy...) Show SMILES Cc1cnc2c(cc(Cn3cc(C(=O)NCc4c(C)cc(N)nc4C)c(n3)C#N)cc2c1)S(C)(=O)=O Show InChI InChI=1S/C25H25N7O3S/c1-14-5-18-7-17(8-22(36(4,34)35)24(18)28-10-14)12-32-13-20(21(9-26)31-32)25(33)29-11-19-15(2)6-23(27)30-16(19)3/h5-8,10,13H,11-12H2,1-4H3,(H2,27,30)(H,29,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392576 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-cy...) Show SMILES Cc1cnc2c(cc(Cn3cc(C(=O)NCc4c(C)cc(N)nc4C)c(n3)C#N)cc2c1)C#N Show InChI InChI=1S/C25H22N8O/c1-14-4-18-6-17(7-19(8-26)24(18)29-10-14)12-33-13-21(22(9-27)32-33)25(34)30-11-20-15(2)5-23(28)31-16(20)3/h4-7,10,13H,11-12H2,1-3H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392578 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-3-cy...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc3ncc(cc3c2)C2CC2)nc1C#N Show InChI InChI=1S/C26H25N7O/c1-15-7-25(28)31-16(2)21(15)12-30-26(34)22-14-33(32-24(22)10-27)13-17-3-6-23-19(8-17)9-20(11-29-23)18-4-5-18/h3,6-9,11,14,18H,4-5,12-13H2,1-2H3,(H2,28,31)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392579 (N-((6-amino-2-methylpyridin-3- yl)methyl)-3-cyano-...) Show SMILES Cc1nc(N)ccc1CNC(=O)c1cn(Cc2ccc3ncc(cc3c2)C2CC2)nc1C#N Show InChI InChI=1S/C25H23N7O/c1-15-18(5-7-24(27)30-15)11-29-25(33)21-14-32(31-23(21)10-26)13-16-2-6-22-19(8-16)9-20(12-28-22)17-3-4-17/h2,5-9,12,14,17H,3-4,11,13H2,1H3,(H2,27,30)(H,29,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM392581 (N-((6-amino-2,4-dimethylpyridin-3- yl)methyl)-1-((...) Show SMILES Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2cc(c3ncc(Cl)cc3c2)S(C)(=O)=O)nc1C#N Show InChI InChI=1S/C24H22ClN7O3S/c1-13-4-22(27)30-14(2)18(13)10-29-24(33)19-12-32(31-20(19)8-26)11-15-5-16-7-17(25)9-28-23(16)21(6-15)36(3,34)35/h4-7,9,12H,10-11H2,1-3H3,(H2,27,30)(H,29,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description A 10 mM solution of the test compound was made in DMSO. This solution was serially diluted 1:5 in DMSO to yield 2000, 400, 80, 16, 3.2, 0.64, 0.128, ...				J Med Chem 52: 1799-802 (2009) BindingDB Entry DOI: 10.7270/Q2CV4M2H
					More data for this Ligand-Target Pair

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