Compile Data Set for Download or QSAR

Found 550 hits with Last Name = 'conroy' and Initial = 'r'   

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
Mitogen-activated protein kinase 11/12/13/14 (Homo sapiens (Human))	BDBM50476508 (CHEMBL234487) Show SMILES [#6]-[#8]-c1ccc(cc1-[#7]-[#6](=O)-[#7]-c1ccc(-[#8]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#8]-[#6]-[#6]-2)c2ccccc12)[Si;v4]([#6])([#6])[#6] Show InChI InChI=1S/C27H35N3O4Si/c1-32-26-11-9-20(35(2,3)4)19-24(26)29-27(31)28-23-10-12-25(22-8-6-5-7-21(22)23)34-18-15-30-13-16-33-17-14-30/h5-12,19H,13-18H2,1-4H3,(H2,28,29,31)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Paradigm Therapeutics Ltd Curated by ChEMBL					Assay Description Inhibition of MAPK p38				Bioorg Med Chem Lett 17: 354-7 (2007) Article DOI: 10.1016/j.bmcl.2006.10.044 BindingDB Entry DOI: 10.7270/Q2KD21NQ
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14 (Homo sapiens (Human))	BDBM50476509 (CHEMBL234486) Show SMILES [#6]-c1ccc(cc1)-n1nc(cc1-[#7]-[#6](=O)-[#7]-c1ccc(-[#8]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#8]-[#6]-[#6]-2)c2ccccc12)[Si;v4]([#6])([#6])[#6] Show InChI InChI=1S/C30H37N5O3Si/c1-22-9-11-23(12-10-22)35-28(21-29(33-35)39(2,3)4)32-30(36)31-26-13-14-27(25-8-6-5-7-24(25)26)38-20-17-34-15-18-37-19-16-34/h5-14,21H,15-20H2,1-4H3,(H2,31,32,36)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Paradigm Therapeutics Ltd Curated by ChEMBL					Assay Description Inhibition of MAPK p38				Bioorg Med Chem Lett 17: 354-7 (2007) Article DOI: 10.1016/j.bmcl.2006.10.044 BindingDB Entry DOI: 10.7270/Q2KD21NQ
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14 (Homo sapiens (Human))	BDBM13533 (1-[2-(4-methylphenyl)-5-tert-butyl-pyrazol-3-yl]-3...) Show SMILES Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C Show InChI InChI=1S/C31H37N5O3/c1-22-9-11-23(12-10-22)36-29(21-28(34-36)31(2,3)4)33-30(37)32-26-13-14-27(25-8-6-5-7-24(25)26)39-20-17-35-15-18-38-19-16-35/h5-14,21H,15-20H2,1-4H3,(H2,32,33,37)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Paradigm Therapeutics Ltd Curated by ChEMBL					Assay Description Inhibition of MAPK p38				Bioorg Med Chem Lett 17: 354-7 (2007) Article DOI: 10.1016/j.bmcl.2006.10.044 BindingDB Entry DOI: 10.7270/Q2KD21NQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Plasma kallikrein (Homo sapiens (Human))	BDBM598454 (N-({2-fluoro-3-methoxy-6-[3-(trifluoromethyl)-1,2,...) Show SMILES COCc1nn(Cc2ccc3CN(Cc3c2)C(C)C)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598460 (3-(difluoromethyl)-N-(2-fluoro-3-methoxy-6-(4-meth...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3cc4CN(C)CC5(CC5)n4n3)nc2C(F)F)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598461 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2cnc3CN(C)CCc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598464 (1-[(4,4-difluoro-2-methyl-1,3-dihydroisoquinolin-6...) Show SMILES COCc1nn(Cc2ccc3CN(C)CC(F)(F)c3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598465 (1-[(4,4-difluoro-2-methyl-1,3-dihydroisoquinolin-7...) Show SMILES COCc1nn(Cc2ccc3c(CN(C)CC3(F)F)c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598466 (1-[(8-fluoro-2-methyl-3,4-dihydro-1H-isoquinolin-7...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2F)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598472 (1-[(8-fluoro-2-methyl-3,4-dihydro-1H-isoquinolin-6...) Show SMILES COCc1nn(Cc2cc(F)c3CN(C)CCc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598474 (1-[(6-fluoro-2-methyl-3,4-dihydro-1H-isoquinolin-7...) Show SMILES COCc1nn(Cc2cc3CN(C)CCc3cc2F)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598400 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598476 (1-{1H,2H,3H,5H,6H,10bH-pyrrolo[2,1-a]isoquinolin-9...) Show SMILES COCc1nn(Cc2ccc3CCN4CCCC4c3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598477 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)CCc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598478 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(CCc3c2)C(C)C)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598481 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3cc4CN(C)CCn4n3)nc2C(F)(F)F)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598482 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3c(CN(C)CC33CC3)c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598483 (1-{2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoqu...) Show SMILES COCc1nn(Cc2ccc3c(CNCC33CC3)c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598492 (3-(difluoromethyl)-N-{[2-fluoro-3-methoxy-6-(4-met...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3cc4CN(C)CCn4n3)nc2C(F)F)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598493 (3-(difluoromethyl)-N-{[2-fluoro-3-methoxy-6-(4-met...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3cnc4CN(C)CCc4c3)nc2C(F)F)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598500 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3ccc4CCN(C)Cc4c3)nn2)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598501 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2cn(Cc3ccc4CN(Cc4c3)C(C)C)nn2)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598503 (N-({2-chloro-6-[3-(difluoromethyl)-1,2,4-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(Cl)c(OC)ccc1-n1cnc(n1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598505 (N-({2-fluoro-3-methoxy-6-[3-(trifluoromethyl)-1,2,...) Show SMILES COCc1nn(Cc2ccc3CCN(C)CCc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598507 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2ccc(=O)n(Cc3ccc4CCN(C)Cc4c3)c2)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598508 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2cncc(Cc3ccc4CCN(C)Cc4c3)c2)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598510 (N-{[2-fluoro-3-methoxy-6-(1,2,3,4-tetrazol-1-yl)ph...) Show SMILES COCc1nn(Cc2ccc3nc(C)ccc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnnn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598511 (N-{[2-fluoro-3-methoxy-6-(1,2,3,4-tetrazol-1-yl)ph...) Show SMILES COCc1nn(Cc2ccc3ncccc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnnn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM528127 (US11180484, Example 79 | US11180484, Reference Exa...) Show SMILES COCc1nn(Cc2cnc(nc2)N2CCCC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnnn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598513 (N-{[2-fluoro-3-methoxy-6-(1,2,3-triazol-1-yl)pheny...) Show SMILES COCc1nn(Cc2cnc(nc2)N2CCCC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1ccnn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598514 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2cnc(nc2)N2CCCC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598515 (N-({6-[4-(difluoromethyl)-1,2,3-triazol-1-yl]-2-fl...) Show SMILES COCc1nn(Cc2cnc(nc2)N2CCCC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(nn1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598399 (N-({6-[4-(difluoromethyl)-1,2,3-triazol-1-yl]-2-fl...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(nn1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598400 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598401 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COc1ccc(c(CNC(=O)c2cnn(Cc3ccc4CCN(C)Cc4c3)c2)c1F)-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598402 (N-{[2-fluoro-3-methoxy-6-(3-methyl-1,2,4-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(C)n1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598403 (N-{[6-(3-ethyl-1,2,4-triazol-1-yl)-2-fluoro-3-meth...) Show SMILES CCc1ncn(n1)-c1ccc(OC)c(F)c1CNC(=O)c1cn(Cc2ccc3CCN(C)Cc3c2)nc1COC Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598404 (N-{[2-fluoro-3-methoxy-6-(1,2,4-triazol-1-yl)pheny...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cncn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598407 (N-{[6-(3-cyanopyrazol-1-yl)-2-fluoro-3-methoxyphen...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1ccc(n1)C#N Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598408 (N-{[2-fluoro-3-methoxy-6-(5-methyl-1,2,4-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1ncnc1C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598409 (N-({2-fluoro-3-methoxy-6-[3-(trifluoromethyl)-1,2,...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598410 (1-[(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-7-yl)...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C2CC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598411 (N-({6-[3-(difluoromethyl)-1,2,4-triazol-1-yl]-2-fl...) Show SMILES COCc1nn(Cc2ccc3CCN(C)Cc3c2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598412 (1-[(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)methyl...) Show SMILES CCN1CCc2ccc(Cn3cc(C(=O)NCc4c(F)c(OC)ccc4-n4cc(C)nn4)c(COC)n3)cc2C1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598413 (N-{[2-fluoro-3-methoxy-6-(4-methyl-1,2,3-triazol-1...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C(C)C)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598414 (1-((2-cyclobutyl-1,2,3,4-tetrahydroisoquinolin-7-y...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C2CCC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cc(C)nn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598415 (1-[(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-7-yl)...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C2CC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598417 (N-{[6-(3-cyanopyrazol-1-yl)-2-fluoro-3-methoxyphen...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C2CC2)cc1C(=O)NCc1c(F)c(OC)ccc1-n1ccc(n1)C#N Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598418 (N-({2-fluoro-3-methoxy-6-[3-(trifluoromethyl)-1,2,...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C(C)C)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM598419 (N-({6-[3-(difluoromethyl)-1,2,4-triazol-1-yl]-2-fl...) Show SMILES COCc1nn(Cc2ccc3CCN(Cc3c2)C(C)C)cc1C(=O)NCc1c(F)c(OC)ccc1-n1cnc(n1)C(F)F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Plasma kallikrein inhibitory activity in vitro was determined using standard published methods (see e.g. Johansen et al., Int. J. Tiss. Reac. 1986, 8...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RF5ZZZ
					More data for this Ligand-Target Pair

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