Compile Data Set for Download or QSAR

Found 720 hits with Last Name = 'li' and Initial = 'jk'   

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
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50331048 (CHEMBL1277437 | ethyl 2-acetamido-7-hydroxy-4-(qui...) Show SMILES CCOC(=O)C1=C(NC(C)=O)Oc2cc(O)ccc2C1c1cnc2ccccc2c1 |c:5| Show InChI InChI=1S/C23H20N2O5/c1-3-29-23(28)21-20(15-10-14-6-4-5-7-18(14)24-12-15)17-9-8-16(27)11-19(17)30-22(21)25-13(2)26/h4-12,20,27H,3H2,1-2H3,(H,25,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449010 (CHEMBL3125960) Show SMILES CCOC(=O)C1C(c2cnc3ccccc3c2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C21H18N2O4/c1-2-26-21(25)19-18(13-9-12-5-3-4-6-16(12)23-11-13)15-8-7-14(24)10-17(15)27-20(19)22/h3-11,18-19,22,24H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449026 (CHEMBL3125936) Show SMILES CCOC(=O)C1=C(NC(C)=O)Oc2cc(O)ccc2C1c1cccnc1 |c:5| Show InChI InChI=1S/C19H18N2O5/c1-3-25-19(24)17-16(12-5-4-8-20-10-12)14-7-6-13(23)9-15(14)26-18(17)21-11(2)22/h4-10,16,23H,3H2,1-2H3,(H,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	480	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449000 (CHEMBL3125942) Show SMILES CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccnc2ccccc12 Show InChI InChI=1S/C21H18N2O4/c1-2-26-21(25)19-18(14-9-10-23-16-6-4-3-5-13(14)16)15-8-7-12(24)11-17(15)27-20(19)22/h3-11,18-19,22,24H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449033 (CHEMBL3125949) Show SMILES CCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H18N2O4/c1-2-8-23-18(22)16-15(11-4-3-7-20-10-11)13-6-5-12(21)9-14(13)24-17(16)19/h3-7,9-10,15-16,19,21H,2,8H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449029 (CHEMBL3125954) Show SMILES Oc1ccc2C(C(C(=O)OCc3ccccc3)C(=N)Oc2c1)c1cccnc1 Show InChI InChI=1S/C22H18N2O4/c23-21-20(22(26)27-13-14-5-2-1-3-6-14)19(15-7-4-10-24-12-15)17-9-8-16(25)11-18(17)28-21/h1-12,19-20,23,25H,13H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449011 (CHEMBL1604159) Show SMILES CCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C17H16N2O4/c1-2-22-17(21)15-14(10-4-3-7-19-9-10)12-6-5-11(20)8-13(12)23-16(15)18/h3-9,14-15,18,20H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449032 (CHEMBL3125950) Show SMILES CCCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C19H20N2O4/c1-2-3-9-24-19(23)17-16(12-5-4-8-21-11-12)14-7-6-13(22)10-15(14)25-18(17)20/h4-8,10-11,16-17,20,22H,2-3,9H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449008 (CHEMBL3125965) Show SMILES CCOC(=O)C1C(c2ccccn2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C17H16N2O4/c1-2-22-17(21)15-14(12-5-3-4-8-19-12)11-7-6-10(20)9-13(11)23-16(15)18/h3-9,14-15,18,20H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449007 (CHEMBL3125966) Show SMILES CCOC(=O)C1C(c2cc3ccccc3cn2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C21H18N2O4/c1-2-26-21(25)19-18(15-8-7-14(24)10-17(15)27-20(19)22)16-9-12-5-3-4-6-13(12)11-23-16/h3-11,18-19,22,24H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449004 (CHEMBL3125937) Show SMILES CCOC(=O)C1C(c2cccc(c2)C#N)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C19H16N2O4/c1-2-24-19(23)17-16(12-5-3-4-11(8-12)10-20)14-7-6-13(22)9-15(14)25-18(17)21/h3-9,16-17,21-22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449001 (CHEMBL3125941) Show SMILES CCOC(=O)C1C(c2ccncc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C17H16N2O4/c1-2-22-17(21)15-14(10-5-7-19-8-6-10)12-4-3-11(20)9-13(12)23-16(15)18/h3-9,14-15,18,20H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449030 (CHEMBL3125952) Show SMILES COCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H18N2O5/c1-23-7-8-24-18(22)16-15(11-3-2-6-20-10-11)13-5-4-12(21)9-14(13)25-17(16)19/h2-6,9-10,15-16,19,21H,7-8H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449034 (CHEMBL3125948) Show SMILES COC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C16H14N2O4/c1-21-16(20)14-13(9-3-2-6-18-8-9)11-5-4-10(19)7-12(11)22-15(14)17/h2-8,13-14,17,19H,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50448996 (CHEMBL3125931) Show SMILES Oc1cccc(c1)C1[C-](C#N)C(=[NH2+])Oc2cc(ccc12)[N+]([O-])=O Show InChI InChI=1S/C16H10N3O4/c17-8-13-15(9-2-1-3-11(20)6-9)12-5-4-10(19(21)22)7-14(12)23-16(13)18/h1-7,15,18,20H/q-1/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50448998 (CHEMBL3125944) Show SMILES CCOC(=O)C1C(c2ccc(cc2)N(C)C)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C20H22N2O4/c1-4-25-20(24)18-17(12-5-7-13(8-6-12)22(2)3)15-10-9-14(23)11-16(15)26-19(18)21/h5-11,17-18,21,23H,4H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449028 (CHEMBL3125932) Show SMILES CCOC(=O)C1C(c2cccnc2)c2cc(Cl)c(O)cc2OC1=N Show InChI InChI=1S/C17H15ClN2O4/c1-2-23-17(22)15-14(9-4-3-5-20-8-9)10-6-11(18)12(21)7-13(10)24-16(15)19/h3-8,14-15,19,21H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50448997 (CHEMBL3125945) Show SMILES CCOC(=O)C1C(c2ccc(OC)c(OC)c2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C20H21NO6/c1-4-26-20(23)18-17(11-5-8-14(24-2)16(9-11)25-3)13-7-6-12(22)10-15(13)27-19(18)21/h5-10,17-18,21-22H,4H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50448999 (CHEMBL1338272) Show SMILES CCOC(=O)[C-]1C(c2ccc(cc2)[N+]([O-])=O)c2ccc(O)cc2OC1=[NH2+] Show InChI InChI=1S/C18H15N2O6/c1-2-25-18(22)16-15(10-3-5-11(6-4-10)20(23)24)13-8-7-12(21)9-14(13)26-17(16)19/h3-9,15,19,21H,2H2,1H3/q-1/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449027 (CHEMBL3125934) Show SMILES CCOC(=O)C1C(c2cccnc2)c2cccc(O)c2OC1=N Show InChI InChI=1S/C17H16N2O4/c1-2-22-17(21)14-13(10-5-4-8-19-9-10)11-6-3-7-12(20)15(11)23-16(14)18/h3-9,13-14,18,20H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449002 (CHEMBL3125940) Show SMILES CCOC(=O)C1C(c2ccc(cc2)C#N)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C19H16N2O4/c1-2-24-19(23)17-16(12-5-3-11(10-20)4-6-12)14-8-7-13(22)9-15(14)25-18(17)21/h3-9,16-17,21-22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449031 (CHEMBL3125951) Show SMILES CC(C)(C)OC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C19H20N2O4/c1-19(2,3)25-18(23)16-15(11-5-4-8-21-10-11)13-7-6-12(22)9-14(13)24-17(16)20/h4-10,15-16,20,22H,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449003 (CHEMBL3125938) Show SMILES CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1c(Cl)ccnc1Cl Show InChI InChI=1S/C17H14Cl2N2O4/c1-2-24-17(23)14-12(13-10(18)5-6-21-15(13)19)9-4-3-8(22)7-11(9)25-16(14)20/h3-7,12,14,20,22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449005 (CHEMBL1511289) Show SMILES CCOC(=O)C1C(c2cccc(Cl)c2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H16ClNO4/c1-2-23-18(22)16-15(10-4-3-5-11(19)8-10)13-7-6-12(21)9-14(13)24-17(16)20/h3-9,15-16,20-21H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449006 (CHEMBL3125967) Show SMILES CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C18H16N2O6/c1-2-25-18(22)16-15(11-5-3-4-6-13(11)20(23)24)12-8-7-10(21)9-14(12)26-17(16)19/h3-9,15-16,19,21H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449009 (CHEMBL1303063) Show SMILES COc1ccc(cc1OC)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C18H16N2O4/c1-22-14-6-3-10(7-16(14)23-2)17-12-5-4-11(21)8-15(12)24-18(20)13(17)9-19/h3-8,13,17,20-21H,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449024 (CHEMBL3125961) Show SMILES COc1cccc(c1)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C17H14N2O3/c1-21-12-4-2-3-10(7-12)16-13-6-5-11(20)8-15(13)22-17(19)14(16)9-18/h2-8,14,16,19-20H,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449025 (CHEMBL1276538) Show SMILES COc1ccc(cc1)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C17H14N2O3/c1-21-12-5-2-10(3-6-12)16-13-7-4-11(20)8-15(13)22-17(19)14(16)9-18/h2-8,14,16,19-20H,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449014 (CHEMBL3125943) Show SMILES CCOC(=O)C1C(c2ccc(cc2)-c2ccccn2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C23H20N2O4/c1-2-28-23(27)21-20(17-11-10-16(26)13-19(17)29-22(21)24)15-8-6-14(7-9-15)18-5-3-4-12-25-18/h3-13,20-21,24,26H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449013 (CHEMBL3125935) Show SMILES CCOC(=O)C1C(c2cccnc2)c2ccc3ccccc3c2OC1=N Show InChI InChI=1S/C21H18N2O3/c1-2-25-21(24)18-17(14-7-5-11-23-12-14)16-10-9-13-6-3-4-8-15(13)19(16)26-20(18)22/h3-12,17-18,22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449012 (CHEMBL1406709) Show SMILES CCOC(=O)C1C(c2cccnc2)c2c(OC1=N)ccc1ccccc21 Show InChI InChI=1S/C21H18N2O3/c1-2-25-21(24)19-17(14-7-5-11-23-12-14)18-15-8-4-3-6-13(15)9-10-16(18)26-20(19)22/h3-12,17,19,22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449023 (CHEMBL3125962) Show SMILES COc1cc(OC)cc(c1)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C18H16N2O4/c1-22-12-5-10(6-13(8-12)23-2)17-14-4-3-11(21)7-16(14)24-18(20)15(17)9-19/h3-8,15,17,20-21H,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449022 (CHEMBL1403937) Show SMILES COc1cc(cc(OC)c1OC)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C19H18N2O5/c1-23-15-6-10(7-16(24-2)18(15)25-3)17-12-5-4-11(22)8-14(12)26-19(21)13(17)9-20/h4-8,13,17,21-22H,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449021 (CHEMBL1556216) Show SMILES Oc1ccc2C(C(C#N)C(=N)Oc2c1)c1cccnc1 Show InChI InChI=1S/C15H11N3O2/c16-7-12-14(9-2-1-5-18-8-9)11-4-3-10(19)6-13(11)20-15(12)17/h1-6,8,12,14,17,19H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449020 (CHEMBL3125963) Show SMILES CN(C)c1ccc(cc1)C1C(C#N)C(=N)Oc2cc(O)ccc12 Show InChI InChI=1S/C18H17N3O2/c1-21(2)12-5-3-11(4-6-12)17-14-8-7-13(22)9-16(14)23-18(20)15(17)10-19/h3-9,15,17,20,22H,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449019 (CHEMBL1603587) Show SMILES CCOC(=O)C1C(c2ccccc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H17NO4/c1-2-22-18(21)16-15(11-6-4-3-5-7-11)13-9-8-12(20)10-14(13)23-17(16)19/h3-10,15-16,19-20H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449018 (CHEMBL3125964) Show SMILES CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccccc1C#N Show InChI InChI=1S/C19H16N2O4/c1-2-24-19(23)17-16(13-6-4-3-5-11(13)10-20)14-8-7-12(22)9-15(14)25-18(17)21/h3-9,16-17,21-22H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449015 (CHEMBL3125939) Show SMILES CCOC(=O)C1C(c2ccc(Cl)cc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H16ClNO4/c1-2-23-18(22)16-15(10-3-5-11(19)6-4-10)13-8-7-12(21)9-14(13)24-17(16)20/h3-9,15-16,20-21H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449016 (CHEMBL1435420) Show SMILES CCOC(=O)C1C(c2ccc(Br)cc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C18H16BrNO4/c1-2-23-18(22)16-15(10-3-5-11(19)6-4-10)13-8-7-12(21)9-14(13)24-17(16)20/h3-9,15-16,20-21H,2H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Leucyl-cystinyl aminopeptidase (Homo sapiens (Human))	BDBM50449017 (CHEMBL1604644) Show SMILES CCOC(=O)C1C(c2ccc(C)cc2)c2ccc(O)cc2OC1=N Show InChI InChI=1S/C19H19NO4/c1-3-23-19(22)17-16(12-6-4-11(2)5-7-12)14-9-8-13(21)10-15(14)24-18(17)20/h4-10,16-17,20-21H,3H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibition of IRAP in HEKT cells assessed as hydrolysis of L-leucine-4-methyl-7-coumarinylamide after 30 mins				J Med Chem 57: 1368-77 (2014) Article DOI: 10.1021/jm401540f BindingDB Entry DOI: 10.7270/Q2W66N8G
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115589 (CHEMBL3609232) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C169H274N54O47S7/c1-14-84(5)126-159(263)207-112(70-125(234)235)150(254)221-131(91(12)230)163(267)219-127(85(6)15-2)164(268)223-63-34-47-122(223)158(262)201-100(42-24-28-57-172)140(244)209-114(74-225)151(255)196-104(46-33-62-188-169(182)183)141(245)212-120-80-275-274-78-118-155(259)198-102(44-31-60-186-167(178)179)136(240)194-101(43-25-29-58-173)144(248)220-130(90(11)229)162(266)215-116(135(239)189-72-124(233)217-128(88(9)227)161(265)216-121(165(269)270)81-277-276-79-119(156(260)218-126)214-153(257)113(73-224)208-134(238)97(174)39-30-59-185-166(176)177)76-272-273-77-117(211-142(246)105(52-53-123(175)232)199-146(250)108(66-92-35-18-16-19-36-92)202-133(237)87(8)192-160(264)129(89(10)228)222-157(120)261)154(258)197-99(41-23-27-56-171)138(242)206-111(69-95-71-184-82-190-95)149(253)210-115(75-226)152(256)200-106(54-64-271-13)143(247)193-98(40-22-26-55-170)137(241)205-110(68-94-48-50-96(231)51-49-94)147(251)195-103(45-32-61-187-168(180)181)139(243)204-107(65-83(3)4)145(249)191-86(7)132(236)203-109(148(252)213-118)67-93-37-20-17-21-38-93/h16-21,35-38,48-51,71,82-91,97-122,126-131,224-231H,14-15,22-34,39-47,52-70,72-81,170-174H2,1-13H3,(H2,175,232)(H,184,190)(H,189,239)(H,191,249)(H,192,264)(H,193,247)(H,194,240)(H,195,251)(H,196,255)(H,197,258)(H,198,259)(H,199,250)(H,200,256)(H,201,262)(H,202,237)(H,203,236)(H,204,243)(H,205,241)(H,206,242)(H,207,263)(H,208,238)(H,209,244)(H,210,253)(H,211,246)(H,212,245)(H,213,252)(H,214,257)(H,215,266)(H,216,265)(H,217,233)(H,218,260)(H,219,267)(H,220,248)(H,221,254)(H,222,261)(H,234,235)(H,269,270)(H4,176,177,185)(H4,178,179,186)(H4,180,181,187)(H4,182,183,188)/t84-,85-,86-,87-,88+,89+,90+,91+,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,126-,127-,128-,129-,130-,131-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115569 (CHEMBL3609231) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C166H268N54O48S7/c1-12-81(3)123-156(261)203-108(67-122(232)233)146(251)218-128(88(10)228)160(265)216-124(82(4)13-2)161(266)220-61-32-45-119(220)155(260)198-97(40-22-26-55-169)137(242)206-111(72-223)147(252)193-101(44-31-60-185-166(179)180)138(243)209-117-78-273-272-76-115-152(257)195-100(43-30-59-184-165(177)178)134(239)191-98(41-23-27-56-170)141(246)217-127(87(9)227)159(264)212-113(132(237)186-69-121(231)214-125(85(7)225)158(263)213-118(162(267)268)79-275-274-77-116(153(258)215-123)211-150(255)110(71-222)205-131(236)94(171)37-28-57-182-163(173)174)74-270-271-75-114(208-139(244)102(50-51-120(172)230)196-142(247)104(63-89-33-16-14-17-34-89)199-129(234)84(6)189-157(262)126(86(8)226)219-154(117)259)151(256)194-96(39-21-25-54-168)136(241)202-107(66-92-68-181-80-187-92)145(250)207-112(73-224)148(253)197-103(52-62-269-11)140(245)190-95(38-20-24-53-167)135(240)200-106(65-91-46-48-93(229)49-47-91)143(248)192-99(42-29-58-183-164(175)176)133(238)188-83(5)130(235)204-109(70-221)149(254)201-105(144(249)210-115)64-90-35-18-15-19-36-90/h14-19,33-36,46-49,68,80-88,94-119,123-128,221-229H,12-13,20-32,37-45,50-67,69-79,167-171H2,1-11H3,(H2,172,230)(H,181,187)(H,186,237)(H,188,238)(H,189,262)(H,190,245)(H,191,239)(H,192,248)(H,193,252)(H,194,256)(H,195,257)(H,196,247)(H,197,253)(H,198,260)(H,199,234)(H,200,240)(H,201,254)(H,202,241)(H,203,261)(H,204,235)(H,205,236)(H,206,242)(H,207,250)(H,208,244)(H,209,243)(H,210,249)(H,211,255)(H,212,264)(H,213,263)(H,214,231)(H,215,258)(H,216,265)(H,217,246)(H,218,251)(H,219,259)(H,232,233)(H,267,268)(H4,173,174,182)(H4,175,176,183)(H4,177,178,184)(H4,179,180,185)/t81-,82-,83-,84-,85+,86+,87+,88+,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,123-,124-,125-,126-,127-,128-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115508 (CHEMBL3609227) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C167H270N54O48S6/c1-13-82(5)124-157(262)204-109(67-123(233)234)147(252)219-129(89(12)229)161(266)217-125(83(6)14-2)162(267)221-61-33-46-120(221)156(261)198-98(41-23-27-55-170)138(243)206-112(72-224)149(254)194-102(45-32-60-186-167(180)181)139(244)210-118-78-273-272-76-116-153(258)196-100(43-30-58-184-165(176)177)134(239)192-99(42-24-28-56-171)141(246)218-128(88(11)228)160(265)213-114(133(238)187-69-122(232)215-126(86(9)226)159(264)214-119(163(268)269)79-275-274-77-117(154(259)216-124)212-151(256)111(71-223)205-132(237)95(172)38-29-57-183-164(174)175)74-270-271-75-115(209-140(245)103(51-52-121(173)231)197-143(248)105(63-90-34-17-15-18-35-90)199-131(236)85(8)190-158(263)127(87(10)227)220-155(118)260)152(257)195-97(40-22-26-54-169)136(241)203-108(66-93-68-182-80-188-93)146(251)207-110(70-222)148(253)189-84(7)130(235)191-96(39-21-25-53-168)135(240)201-107(65-92-47-49-94(230)50-48-92)144(249)193-101(44-31-59-185-166(178)179)137(242)200-104(62-81(3)4)142(247)208-113(73-225)150(255)202-106(145(250)211-116)64-91-36-19-16-20-37-91/h15-20,34-37,47-50,68,80-89,95-120,124-129,222-230H,13-14,21-33,38-46,51-67,69-79,168-172H2,1-12H3,(H2,173,231)(H,182,188)(H,187,238)(H,189,253)(H,190,263)(H,191,235)(H,192,239)(H,193,249)(H,194,254)(H,195,257)(H,196,258)(H,197,248)(H,198,261)(H,199,236)(H,200,242)(H,201,240)(H,202,255)(H,203,241)(H,204,262)(H,205,237)(H,206,243)(H,207,251)(H,208,247)(H,209,245)(H,210,244)(H,211,250)(H,212,256)(H,213,265)(H,214,264)(H,215,232)(H,216,259)(H,217,266)(H,218,246)(H,219,252)(H,220,260)(H,233,234)(H,268,269)(H4,174,175,183)(H4,176,177,184)(H4,178,179,185)(H4,180,181,186)/t82-,83-,84-,85-,86+,87+,88+,89+,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,124-,125-,126-,127-,128-,129-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115776 (CHEMBL3609037) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C172H281N57O47S7/c1-13-86(5)128-161(269)213-114(72-127(240)241)152(260)227-133(92(11)236)165(273)225-129(87(6)14-2)166(274)229-65-34-48-124(229)160(268)207-101(42-23-27-58-175)141(249)214-115(75-230)153(261)202-106(47-33-64-194-172(187)188)143(251)219-122-82-281-280-80-120-157(265)204-104(45-31-62-192-170(183)184)137(245)200-102(43-24-28-59-176)146(254)226-132(91(10)235)164(272)221-118(136(244)195-74-126(239)223-130(89(8)233)163(271)222-123(167(275)276)83-283-282-81-121(158(266)224-128)218-142(250)103(44-30-61-191-169(181)182)198-135(243)98(177)39-29-60-190-168(179)180)78-278-279-79-119(217-144(252)107(53-54-125(178)238)205-148(256)110(68-93-35-17-15-18-36-93)208-134(242)88(7)197-162(270)131(90(9)234)228-159(122)267)156(264)203-100(41-22-26-57-174)139(247)212-113(71-96-73-189-84-196-96)151(259)216-116(76-231)154(262)206-108(55-66-277-12)145(253)199-99(40-21-25-56-173)138(246)210-112(70-95-49-51-97(237)52-50-95)149(257)201-105(46-32-63-193-171(185)186)140(248)209-109(67-85(3)4)147(255)215-117(77-232)155(263)211-111(150(258)220-120)69-94-37-19-16-20-38-94/h15-20,35-38,49-52,73,84-92,98-124,128-133,230-237H,13-14,21-34,39-48,53-72,74-83,173-177H2,1-12H3,(H2,178,238)(H,189,196)(H,195,244)(H,197,270)(H,198,243)(H,199,253)(H,200,245)(H,201,257)(H,202,261)(H,203,264)(H,204,265)(H,205,256)(H,206,262)(H,207,268)(H,208,242)(H,209,248)(H,210,246)(H,211,263)(H,212,247)(H,213,269)(H,214,249)(H,215,255)(H,216,259)(H,217,252)(H,218,250)(H,219,251)(H,220,258)(H,221,272)(H,222,271)(H,223,239)(H,224,266)(H,225,273)(H,226,254)(H,227,260)(H,228,267)(H,240,241)(H,275,276)(H4,179,180,190)(H4,181,182,191)(H4,183,184,192)(H4,185,186,193)(H4,187,188,194)/t86-,87-,88-,89+,90+,91+,92+,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,128-,129-,130-,131-,132-,133-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115603 (CHEMBL3609245) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1cccc3ccccc13)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C179H280N54O47S7/c1-13-91(5)136-169(273)217-122(77-135(244)245)160(264)231-141(97(11)240)173(277)229-137(92(6)14-2)174(278)233-69-36-53-132(233)168(272)210-109(48-25-29-63-182)148(252)215-120(75-102-43-31-42-101-41-21-22-44-105(101)102)158(262)205-113(52-35-68-198-179(192)193)150(254)222-130-87-285-284-85-128-165(269)207-111(50-33-66-196-177(188)189)145(249)203-110(49-26-30-64-183)153(257)230-140(96(10)239)172(276)225-126(144(248)199-79-134(243)227-138(94(8)237)171(275)226-131(175(279)280)88-287-286-86-129(166(270)228-136)224-163(267)123(80-234)218-143(247)106(184)45-32-65-195-176(186)187)83-282-283-84-127(221-151(255)114(58-59-133(185)242)208-155(259)117(72-98-37-17-15-18-38-98)211-142(246)93(7)201-170(274)139(95(9)238)232-167(130)271)164(268)206-108(47-24-28-62-181)147(251)216-121(76-103-78-194-89-200-103)159(263)220-124(81-235)161(265)209-115(60-70-281-12)152(256)202-107(46-23-27-61-180)146(250)213-119(74-100-54-56-104(241)57-55-100)156(260)204-112(51-34-67-197-178(190)191)149(253)212-116(71-90(3)4)154(258)219-125(82-236)162(266)214-118(157(261)223-128)73-99-39-19-16-20-40-99/h15-22,31,37-44,54-57,78,89-97,106-132,136-141,234-241H,13-14,23-30,32-36,45-53,58-77,79-88,180-184H2,1-12H3,(H2,185,242)(H,194,200)(H,199,248)(H,201,274)(H,202,256)(H,203,249)(H,204,260)(H,205,262)(H,206,268)(H,207,269)(H,208,259)(H,209,265)(H,210,272)(H,211,246)(H,212,253)(H,213,250)(H,214,266)(H,215,252)(H,216,251)(H,217,273)(H,218,247)(H,219,258)(H,220,263)(H,221,255)(H,222,254)(H,223,261)(H,224,267)(H,225,276)(H,226,275)(H,227,243)(H,228,270)(H,229,277)(H,230,257)(H,231,264)(H,232,271)(H,244,245)(H,279,280)(H4,186,187,195)(H4,188,189,196)(H4,190,191,197)(H4,192,193,198)/t91-,92-,93-,94+,95+,96+,97+,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,136-,137-,138-,139-,140-,141-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115637 (CHEMBL3609074) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C169H279N53O48S7/c1-13-85(5)126-159(263)205-111(72-125(234)235)149(253)220-131(91(11)230)163(267)218-127(86(6)14-2)164(268)222-66-35-49-122(222)158(262)200-100(44-24-29-60-173)140(244)208-113(75-224)150(254)195-104(48-34-65-188-169(183)184)141(245)211-120-82-275-274-80-118-155(259)197-102(46-32-63-186-167(179)180)136(240)193-101(45-25-30-61-174)144(248)219-130(90(10)229)162(266)214-116(134(238)189-73-124(233)216-128(88(8)227)161(265)215-121(165(269)270)83-277-276-81-119(156(260)217-126)213-153(257)112(74-223)206-133(237)96(175)40-31-62-185-166(177)178)78-272-273-79-117(210-142(246)105(54-55-123(176)232)198-146(250)108(69-92-36-17-15-18-37-92)201-132(236)87(7)190-160(264)129(89(9)228)221-157(120)261)154(258)196-97(41-21-26-57-170)135(239)191-99(43-23-28-59-172)139(243)207-114(76-225)151(255)199-106(56-67-271-12)143(247)192-98(42-22-27-58-171)137(241)203-110(71-94-50-52-95(231)53-51-94)147(251)194-103(47-33-64-187-168(181)182)138(242)202-107(68-84(3)4)145(249)209-115(77-226)152(256)204-109(148(252)212-118)70-93-38-19-16-20-39-93/h15-20,36-39,50-53,84-91,96-122,126-131,223-231H,13-14,21-35,40-49,54-83,170-175H2,1-12H3,(H2,176,232)(H,189,238)(H,190,264)(H,191,239)(H,192,247)(H,193,240)(H,194,251)(H,195,254)(H,196,258)(H,197,259)(H,198,250)(H,199,255)(H,200,262)(H,201,236)(H,202,242)(H,203,241)(H,204,256)(H,205,263)(H,206,237)(H,207,243)(H,208,244)(H,209,249)(H,210,246)(H,211,245)(H,212,252)(H,213,257)(H,214,266)(H,215,265)(H,216,233)(H,217,260)(H,218,267)(H,219,248)(H,220,253)(H,221,261)(H,234,235)(H,269,270)(H4,177,178,185)(H4,179,180,186)(H4,181,182,187)(H4,183,184,188)/t85-,86-,87-,88+,89+,90+,91+,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,126-,127-,128-,129-,130-,131-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115638 (CHEMBL3609075) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C172H281N55O47S7/c1-13-87(5)129-162(267)211-115(73-128(238)239)153(258)225-134(93(11)234)166(271)223-130(88(6)14-2)167(272)227-66-35-49-125(227)161(266)205-103(44-24-29-60-176)143(248)213-117(77-229)154(259)200-107(48-34-65-192-172(186)187)144(249)216-123-83-279-278-81-121-158(263)202-105(46-32-63-190-170(182)183)139(244)197-104(45-25-30-61-177)147(252)224-133(92(10)233)165(270)219-119(137(242)193-75-127(237)221-131(90(8)231)164(269)220-124(168(273)274)84-281-280-82-122(159(264)222-129)218-156(261)116(76-228)212-136(241)99(178)40-31-62-189-169(180)181)79-276-277-80-120(215-145(250)108(54-55-126(179)236)203-149(254)111(69-94-36-17-15-18-37-94)206-135(240)89(7)195-163(268)132(91(9)232)226-160(123)265)157(262)201-102(43-23-28-59-175)141(246)210-114(72-97-74-188-85-194-97)152(257)198-100(41-21-26-57-173)138(243)204-109(56-67-275-12)146(251)196-101(42-22-27-58-174)140(245)208-113(71-96-50-52-98(235)53-51-96)150(255)199-106(47-33-64-191-171(184)185)142(247)207-110(68-86(3)4)148(253)214-118(78-230)155(260)209-112(151(256)217-121)70-95-38-19-16-20-39-95/h15-20,36-39,50-53,74,85-93,99-125,129-134,228-235H,13-14,21-35,40-49,54-73,75-84,173-178H2,1-12H3,(H2,179,236)(H,188,194)(H,193,242)(H,195,268)(H,196,251)(H,197,244)(H,198,257)(H,199,255)(H,200,259)(H,201,262)(H,202,263)(H,203,254)(H,204,243)(H,205,266)(H,206,240)(H,207,247)(H,208,245)(H,209,260)(H,210,246)(H,211,267)(H,212,241)(H,213,248)(H,214,253)(H,215,250)(H,216,249)(H,217,256)(H,218,261)(H,219,270)(H,220,269)(H,221,237)(H,222,264)(H,223,271)(H,224,252)(H,225,258)(H,226,265)(H,238,239)(H,273,274)(H4,180,181,189)(H4,182,183,190)(H4,184,185,191)(H4,186,187,192)/t87-,88-,89-,90+,91+,92+,93+,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,129-,130-,131-,132-,133-,134-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115632 (CHEMBL3609069) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C169H274N52O48S7/c1-13-85(5)127-160(262)204-112(70-126(233)234)150(252)219-132(91(11)229)164(266)217-128(86(6)14-2)165(267)221-63-34-47-123(221)159(261)198-101(43-24-29-58-173)140(242)206-114(74-223)151(253)193-100(42-23-28-57-172)141(243)210-121-81-274-273-79-119-156(258)195-103(45-32-61-185-168(179)180)136(238)191-102(44-25-30-59-174)144(246)218-131(90(10)228)163(265)213-117(135(237)187-72-125(232)215-129(88(8)226)162(264)214-122(166(268)269)82-276-275-80-120(157(259)216-127)212-154(256)113(73-222)205-134(236)97(175)39-31-60-184-167(177)178)77-271-272-78-118(209-142(244)105(52-53-124(176)231)196-146(248)108(66-92-35-17-15-18-36-92)199-133(235)87(7)189-161(263)130(89(9)227)220-158(121)260)155(257)194-99(41-22-27-56-171)138(240)203-111(69-95-71-183-83-188-95)149(251)208-115(75-224)152(254)197-106(54-64-270-12)143(245)190-98(40-21-26-55-170)137(239)201-110(68-94-48-50-96(230)51-49-94)147(249)192-104(46-33-62-186-169(181)182)139(241)200-107(65-84(3)4)145(247)207-116(76-225)153(255)202-109(148(250)211-119)67-93-37-19-16-20-38-93/h15-20,35-38,48-51,71,83-91,97-123,127-132,222-230H,13-14,21-34,39-47,52-70,72-82,170-175H2,1-12H3,(H2,176,231)(H,183,188)(H,187,237)(H,189,263)(H,190,245)(H,191,238)(H,192,249)(H,193,253)(H,194,257)(H,195,258)(H,196,248)(H,197,254)(H,198,261)(H,199,235)(H,200,241)(H,201,239)(H,202,255)(H,203,240)(H,204,262)(H,205,236)(H,206,242)(H,207,247)(H,208,251)(H,209,244)(H,210,243)(H,211,250)(H,212,256)(H,213,265)(H,214,264)(H,215,232)(H,216,259)(H,217,266)(H,218,246)(H,219,252)(H,220,260)(H,233,234)(H,268,269)(H4,177,178,184)(H4,179,180,185)(H4,181,182,186)/t85-,86-,87-,88+,89+,90+,91+,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,127-,128-,129-,130-,131-,132-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115504 (CHEMBL3609223) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](C)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C167H271N53O47S7/c1-14-83(5)124-157(260)203-110(68-123(231)232)147(250)218-129(90(12)228)161(264)216-125(84(6)15-2)162(265)220-61-34-47-121(220)156(259)197-99(42-24-28-55-170)138(241)205-112(72-222)148(251)193-103(46-33-60-185-167(179)180)139(242)209-119-79-272-271-77-117-153(256)195-101(44-31-58-183-165(175)176)134(237)191-100(43-25-29-56-171)141(244)217-128(89(11)227)160(263)212-115(133(236)186-70-122(230)214-126(87(9)225)159(262)213-120(163(266)267)80-274-273-78-118(154(257)215-124)211-151(254)111(71-221)204-132(235)96(172)39-30-57-182-164(173)174)75-269-270-76-116(208-131(234)85(7)188-142(245)106(64-91-35-18-16-19-36-91)198-130(233)86(8)189-158(261)127(88(10)226)219-155(119)258)152(255)194-98(41-23-27-54-169)136(239)202-109(67-94-69-181-81-187-94)146(249)207-113(73-223)149(252)196-104(52-62-268-13)140(243)190-97(40-22-26-53-168)135(238)200-108(66-93-48-50-95(229)51-49-93)144(247)192-102(45-32-59-184-166(177)178)137(240)199-105(63-82(3)4)143(246)206-114(74-224)150(253)201-107(145(248)210-117)65-92-37-20-17-21-38-92/h16-21,35-38,48-51,69,81-90,96-121,124-129,221-229H,14-15,22-34,39-47,52-68,70-80,168-172H2,1-13H3,(H,181,187)(H,186,236)(H,188,245)(H,189,261)(H,190,243)(H,191,237)(H,192,247)(H,193,251)(H,194,255)(H,195,256)(H,196,252)(H,197,259)(H,198,233)(H,199,240)(H,200,238)(H,201,253)(H,202,239)(H,203,260)(H,204,235)(H,205,241)(H,206,246)(H,207,249)(H,208,234)(H,209,242)(H,210,248)(H,211,254)(H,212,263)(H,213,262)(H,214,230)(H,215,257)(H,216,264)(H,217,244)(H,218,250)(H,219,258)(H,231,232)(H,266,267)(H4,173,174,182)(H4,175,176,183)(H4,177,178,184)(H4,179,180,185)/t83-,84-,85-,86-,87+,88+,89+,90+,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,124-,125-,126-,127-,128-,129-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 1 (Homo sapiens (Human))	BDBM50115501 (CHEMBL3609220) Show SMILES [H][C@@]12CCCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](CC(O)=O)NC(=O)[C@@]([H])(NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](C)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CCCCN)NC3=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC2=O)[C@@H](C)O)[C@@H](C)O)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC |r| Show InChI InChI=1S/C166H267N51O48S7/c1-14-82(5)124-157(258)200-109(67-123(229)230)147(248)215-129(89(12)225)161(262)213-125(83(6)15-2)162(263)217-60-33-45-120(217)156(257)194-98(41-24-28-55-169)138(239)202-110(70-218)148(249)185-84(7)131(232)205-117-77-270-269-76-116-153(254)191-100(43-31-58-181-165(175)176)134(235)188-99(42-25-29-56-170)141(242)214-128(88(11)224)160(261)209-114(133(234)183-69-122(228)211-126(86(9)222)159(260)210-119(163(264)265)79-272-271-78-118(154(255)212-124)208-151(252)111(71-219)201-132(233)95(171)38-30-57-180-164(173)174)74-267-268-75-115(206-139(240)102(50-51-121(172)227)192-143(244)105(63-90-34-18-16-19-35-90)195-130(231)85(8)186-158(259)127(87(10)223)216-155(117)256)152(253)190-97(40-23-27-54-168)136(237)199-108(66-93-68-179-80-184-93)146(247)204-112(72-220)149(250)193-103(52-61-266-13)140(241)187-96(39-22-26-53-167)135(236)197-107(65-92-46-48-94(226)49-47-92)144(245)189-101(44-32-59-182-166(177)178)137(238)196-104(62-81(3)4)142(243)203-113(73-221)150(251)198-106(145(246)207-116)64-91-36-20-17-21-37-91/h16-21,34-37,46-49,68,80-89,95-120,124-129,218-226H,14-15,22-33,38-45,50-67,69-79,167-171H2,1-13H3,(H2,172,227)(H,179,184)(H,183,234)(H,185,249)(H,186,259)(H,187,241)(H,188,235)(H,189,245)(H,190,253)(H,191,254)(H,192,244)(H,193,250)(H,194,257)(H,195,231)(H,196,238)(H,197,236)(H,198,251)(H,199,237)(H,200,258)(H,201,233)(H,202,239)(H,203,243)(H,204,247)(H,205,232)(H,206,240)(H,207,246)(H,208,252)(H,209,261)(H,210,260)(H,211,228)(H,212,255)(H,213,262)(H,214,242)(H,215,248)(H,216,256)(H,229,230)(H,264,265)(H4,173,174,180)(H4,175,176,181)(H4,177,178,182)/t82-,83-,84-,85-,86+,87+,88+,89+,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,124-,125-,126-,127-,128-,129-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.00200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.1 expressed in HEK293 cells assessed as inhibition of potassium currents after 10 mins by IonWorks Quattro patch cla...				J Med Chem 58: 6784-802 (2015) Article DOI: 10.1021/acs.jmedchem.5b00495 BindingDB Entry DOI: 10.7270/Q22V2HWG
					More data for this Ligand-Target Pair

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