Compile Data Set for Download or QSAR

Found 112 hits with Last Name = 'krappmann' and Initial = 'd'   

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
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50514789 (CHEMBL4564966) Show SMILES CC(C)C[C@H](NC(=O)CCCCCn1cc(CCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)nn1)C(=O)N[C@@H](C(C)C)C(=O)N1CCCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:19,22,25| Show InChI InChI=1S/C57H83BF2N12O7/c1-34(2)29-45(64-48(74)25-12-11-14-27-69-32-42(67-68-69)21-17-22-43-51-38(7)30-40(9)71(51)58(59,60)72-41(10)31-39(8)52(43)72)53(75)66-50(35(3)4)55(77)70-28-15-13-24-46(70)54(76)65-44(23-18-26-63-57(61)62)47(73)33-79-56(78)49-36(5)19-16-20-37(49)6/h16,19-20,30-32,34-35,44-46,50H,11-15,17-18,21-29,33H2,1-10H3,(H,64,74)(H,65,76)(H,66,75)(H4,61,62,63)/t44-,45-,46-,50-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of full length wild type human N-terminal GST-tagged MALT1 catalytic domain (325 to 760 residues) expressed in Escherichia coli BL21 (DE3)...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50514790 (CHEMBL4565998) Show SMILES CC(C)C[C@H](NC(=O)CCCCCn1cc(CCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)nn1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:19,22,25| Show InChI InChI=1S/C54H79BF2N12O8/c1-31(2)25-42(61-45(72)22-12-11-13-24-67-28-39(65-66-67)19-15-20-40-48-35(7)26-37(9)68(48)55(56,57)69-38(10)27-36(8)49(40)69)50(73)64-47(32(3)4)52(75)63-43(29-70)51(74)62-41(21-16-23-60-54(58)59)44(71)30-77-53(76)46-33(5)17-14-18-34(46)6/h14,17-18,26-28,31-32,41-43,47,70H,11-13,15-16,19-25,29-30H2,1-10H3,(H,61,72)(H,62,74)(H,63,75)(H,64,73)(H4,58,59,60)/t41-,42-,43-,47-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of full length wild type human N-terminal GST-tagged MALT1 catalytic domain (325 to 760 residues) expressed in Escherichia coli BL21 (DE3)...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50514790 (CHEMBL4565998) Show SMILES CC(C)C[C@H](NC(=O)CCCCCn1cc(CCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)nn1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:19,22,25| Show InChI InChI=1S/C54H79BF2N12O8/c1-31(2)25-42(61-45(72)22-12-11-13-24-67-28-39(65-66-67)19-15-20-40-48-35(7)26-37(9)68(48)55(56,57)69-38(10)27-36(8)49(40)69)50(73)64-47(32(3)4)52(75)63-43(29-70)51(74)62-41(21-16-23-60-54(58)59)44(71)30-77-53(76)46-33(5)17-14-18-34(46)6/h14,17-18,26-28,31-32,41-43,47,70H,11-13,15-16,19-25,29-30H2,1-10H3,(H,61,72)(H,62,74)(H,63,75)(H,64,73)(H4,58,59,60)/t41-,42-,43-,47-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of recombinant human cathepsin B expressed in Escherichia coli BL21 (DE3) using zRR-AMC as substrate measured after 2 hrs by fluorescence ...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50069985 ((S)-4-methyl-2-(3-phenyl-propionylamino)-pentanoic...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O |r| Show InChI InChI=1S/C26H41N3O5/c1-17(2)12-21(15-30)27-24(31)22(13-18(3)4)28-25(32)23(14-19(5)6)29-26(33)34-16-20-10-8-7-9-11-20/h7-11,15,17-19,21-23H,12-14,16H2,1-6H3,(H,27,31)(H,28,32)(H,29,33)/t21-,22-,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of human liver cathepsin B using Cbz-RR-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50514791 (CHEMBL3814336) Show SMILES CC(C)C[C@H](NC(=O)CCc1ccc2C=C3C(C)=CC(C)=[N+]3[B-](F)(F)n12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:17,20,t:14| Show InChI InChI=1S/C45H65BF2N12O8/c1-25(2)20-34(55-38(63)17-16-30-14-15-31-22-36-28(5)21-29(6)59(36)46(47,48)60(30)31)41(65)57-33(13-9-19-54-45(51)52)40(64)58-35(23-61)42(66)56-32(12-8-18-53-44(49)50)37(62)24-68-43(67)39-26(3)10-7-11-27(39)4/h7,10-11,14-15,21-22,25,32-35,61H,8-9,12-13,16-20,23-24H2,1-6H3,(H,55,63)(H,56,66)(H,57,65)(H,58,64)(H4,49,50,53)(H4,51,52,54)/t32-,33-,34-,35-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	340	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of full length wild type human N-terminal GST-tagged MALT1 catalytic domain (325 to 760 residues) expressed in Escherichia coli BL21 (DE3)...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50514791 (CHEMBL3814336) Show SMILES CC(C)C[C@H](NC(=O)CCc1ccc2C=C3C(C)=CC(C)=[N+]3[B-](F)(F)n12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:17,20,t:14| Show InChI InChI=1S/C45H65BF2N12O8/c1-25(2)20-34(55-38(63)17-16-30-14-15-31-22-36-28(5)21-29(6)59(36)46(47,48)60(30)31)41(65)57-33(13-9-19-54-45(51)52)40(64)58-35(23-61)42(66)56-32(12-8-18-53-44(49)50)37(62)24-68-43(67)39-26(3)10-7-11-27(39)4/h7,10-11,14-15,21-22,25,32-35,61H,8-9,12-13,16-20,23-24H2,1-6H3,(H,55,63)(H,56,66)(H,57,65)(H,58,64)(H4,49,50,53)(H4,51,52,54)/t32-,33-,34-,35-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of recombinant human cathepsin B expressed in Escherichia coli BL21 (DE3) using zRR-AMC as substrate measured after 2 hrs by fluorescence ...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Calpain-2 catalytic subunit (Homo sapiens (Human))	BDBM50069985 ((S)-4-methyl-2-(3-phenyl-propionylamino)-pentanoic...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O |r| Show InChI InChI=1S/C26H41N3O5/c1-17(2)12-21(15-30)27-24(31)22(13-18(3)4)28-25(32)23(14-19(5)6)29-26(33)34-16-20-10-8-7-9-11-20/h7-11,15,17-19,21-23H,12-14,16H2,1-6H3,(H,27,31)(H,28,32)(H,29,33)/t21-,22-,23-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	653	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of m-calpain (unknown origin) using Suc-LY-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Calpain-2 catalytic subunit (Homo sapiens (Human))	BDBM50169089 (CHEMBL3804980) Show SMILES COc1ccc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C=O)cc1 |r| Show InChI InChI=1S/C42H48N4O7/c1-29(2)23-34(27-47)43-39(48)36(24-30-13-7-4-8-14-30)44-40(49)37(26-32-19-21-35(52-3)22-20-32)45-41(50)38(25-31-15-9-5-10-16-31)46-42(51)53-28-33-17-11-6-12-18-33/h4-22,27,29,34,36-38H,23-26,28H2,1-3H3,(H,43,48)(H,44,49)(H,45,50)(H,46,51)/t34-,36-,37-,38-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.71E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of m-calpain (unknown origin) using Suc-LY-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Calpain-2 catalytic subunit (Homo sapiens (Human))	BDBM50169088 (CHEMBL3806032) Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccc(Oc3cc(C[C@H](NC(=O)OCc4ccccc4)C(=O)N[C@@H](CC(C)C)C(=O)N1)ccc3[N+]([O-])=O)cc2)C=O |r| Show InChI InChI=1S/C38H45N5O9/c1-23(2)16-28(21-44)39-35(45)31-18-25-10-13-29(14-11-25)52-34-20-27(12-15-33(34)43(49)50)19-32(37(47)40-30(17-24(3)4)36(46)41-31)42-38(48)51-22-26-8-6-5-7-9-26/h5-15,20-21,23-24,28,30-32H,16-19,22H2,1-4H3,(H,39,45)(H,40,47)(H,41,46)(H,42,48)/t28-,30-,31-,32-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of m-calpain (unknown origin) using Suc-LY-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50169089 (CHEMBL3804980) Show SMILES COc1ccc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C=O)cc1 |r| Show InChI InChI=1S/C42H48N4O7/c1-29(2)23-34(27-47)43-39(48)36(24-30-13-7-4-8-14-30)44-40(49)37(26-32-19-21-35(52-3)22-20-32)45-41(50)38(25-31-15-9-5-10-16-31)46-42(51)53-28-33-17-11-6-12-18-33/h4-22,27,29,34,36-38H,23-26,28H2,1-3H3,(H,43,48)(H,44,49)(H,45,50)(H,46,51)/t34-,36-,37-,38-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of human liver cathepsin B using Cbz-RR-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Calpain-2 catalytic subunit (Homo sapiens (Human))	BDBM50169087 (CHEMBL3805992) Show SMILES COc1ccc(C[C@@H]2NC(=O)[C@H](Cc3ccc(c(Oc4ccc(C[C@H](NC2=O)C(=O)N[C@@H](CC(C)C)C=O)cc4)c3)[N+]([O-])=O)NC(=O)OCc2ccccc2)cc1 |r| Show InChI InChI=1S/C42H45N5O10/c1-26(2)19-31(24-48)43-39(49)34-20-28-11-16-33(17-12-28)57-38-23-30(13-18-37(38)47(53)54)22-36(46-42(52)56-25-29-7-5-4-6-8-29)41(51)45-35(40(50)44-34)21-27-9-14-32(55-3)15-10-27/h4-18,23-24,26,31,34-36H,19-22,25H2,1-3H3,(H,43,49)(H,44,50)(H,45,51)(H,46,52)/t31-,34-,35-,36-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of m-calpain (unknown origin) using Suc-LY-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50169088 (CHEMBL3806032) Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccc(Oc3cc(C[C@H](NC(=O)OCc4ccccc4)C(=O)N[C@@H](CC(C)C)C(=O)N1)ccc3[N+]([O-])=O)cc2)C=O |r| Show InChI InChI=1S/C38H45N5O9/c1-23(2)16-28(21-44)39-35(45)31-18-25-10-13-29(14-11-25)52-34-20-27(12-15-33(34)43(49)50)19-32(37(47)40-30(17-24(3)4)36(46)41-31)42-38(48)51-22-26-8-6-5-7-9-26/h5-15,20-21,23-24,28,30-32H,16-19,22H2,1-4H3,(H,39,45)(H,40,47)(H,41,46)(H,42,48)/t28-,30-,31-,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.05E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of human liver cathepsin B using Cbz-RR-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50514789 (CHEMBL4564966) Show SMILES CC(C)C[C@H](NC(=O)CCCCCn1cc(CCCC2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c23)nn1)C(=O)N[C@@H](C(C)C)C(=O)N1CCCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)COC(=O)c1c(C)cccc1C |r,c:19,22,25| Show InChI InChI=1S/C57H83BF2N12O7/c1-34(2)29-45(64-48(74)25-12-11-14-27-69-32-42(67-68-69)21-17-22-43-51-38(7)30-40(9)71(51)58(59,60)72-41(10)31-39(8)52(43)72)53(75)66-50(35(3)4)55(77)70-28-15-13-24-46(70)54(76)65-44(23-18-26-63-57(61)62)47(73)33-79-56(78)49-36(5)19-16-20-37(49)6/h16,19-20,30-32,34-35,44-46,50H,11-15,17-18,21-29,33H2,1-10H3,(H,64,74)(H,65,76)(H,66,75)(H4,61,62,63)/t44-,45-,46-,50-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of recombinant human cathepsin B expressed in Escherichia coli BL21 (DE3) using zRR-AMC as substrate measured after 2 hrs by fluorescence ...				J Med Chem 63: 3996-4004 (2020) Article DOI: 10.1021/acs.jmedchem.9b01879 BindingDB Entry DOI: 10.7270/Q2SN0DBR
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50169087 (CHEMBL3805992) Show SMILES COc1ccc(C[C@@H]2NC(=O)[C@H](Cc3ccc(c(Oc4ccc(C[C@H](NC2=O)C(=O)N[C@@H](CC(C)C)C=O)cc4)c3)[N+]([O-])=O)NC(=O)OCc2ccccc2)cc1 |r| Show InChI InChI=1S/C42H45N5O10/c1-26(2)19-31(24-48)43-39(49)34-20-28-11-16-33(17-12-28)57-38-23-30(13-18-37(38)47(53)54)22-36(46-42(52)56-25-29-7-5-4-6-8-29)41(51)45-35(40(50)44-34)21-27-9-14-32(55-3)15-10-27/h4-18,23-24,26,31,34-36H,19-22,25H2,1-3H3,(H,43,49)(H,44,50)(H,45,51)(H,46,52)/t31-,34-,35-,36-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.03E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Whitman College Curated by ChEMBL					Assay Description Inhibition of human liver cathepsin B using Cbz-RR-AMC as substrate by fluorometric assay				ACS Med Chem Lett 7: 250-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00401 BindingDB Entry DOI: 10.7270/Q2222WPD
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260159 (BDBM50177661 | US9504692, Mepezine) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of GST-MALT1 (325 to 760 residues) (unknown origin) using Ac-LRSR-AMC as substrate by fluorescence analysis				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260181 (US9504692, 4116) Show SMILES CN1CCC(O)C(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C19H22N2OS/c1-20-11-10-17(22)14(12-20)13-21-15-6-2-4-8-18(15)23-19-9-5-3-7-16(19)21/h2-9,14,17,22H,10-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260159 (BDBM50177661 | US9504692, Mepezine) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant full length GST-MALT1 (unknown origin) expressed in Escherichia coli using Ac-LRSR-AMC as substrate by fluorescence analysi...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260159 (BDBM50177661 | US9504692, Mepezine) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260190 (US9504692, 3998) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccc(Cl)cc23)C1 Show InChI InChI=1S/C19H21ClN2S/c1-21-10-4-5-14(12-21)13-22-16-6-2-3-7-18(16)23-19-9-8-15(20)11-17(19)22/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260193 (US9504692, 4057) Show SMILES CN1CCCC(CN2c3ccccc3Sc3cc(Cl)ccc23)C1 Show InChI InChI=1S/C19H21ClN2S/c1-21-10-4-5-14(12-21)13-22-16-6-2-3-7-18(16)23-19-11-15(20)8-9-17(19)22/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	973	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260178 (US9504692, 3916) Show SMILES CN1CCOC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C18H20N2OS/c1-19-10-11-21-14(12-19)13-20-15-6-2-4-8-17(15)22-18-9-5-3-7-16(18)20/h2-9,14H,10-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.18E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260172 (US9504692, 3951) Show SMILES CCN1CCCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C20H24N2S/c1-2-21-13-7-8-16(14-21)15-22-17-9-3-5-11-19(17)23-20-12-6-4-10-18(20)22/h3-6,9-12,16H,2,7-8,13-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.42E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177471 (CHEMBL3813831) Show SMILES COCCOc1nc(-c2ccc(Br)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18BrClN4O3/c1-27-10-11-28-19-23-18(13-2-4-14(20)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-21/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 10 to 1000 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyph...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177471 (CHEMBL3813831) Show SMILES COCCOc1nc(-c2ccc(Br)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18BrClN4O3/c1-27-10-11-28-19-23-18(13-2-4-14(20)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-21/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 10 to 1000 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyph...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177153 (CHEMBL3814576) Show SMILES COCCOc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18Cl2N4O3/c1-27-10-11-28-19-23-18(13-2-4-14(21)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-20/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 10 to 1000 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyph...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177153 (CHEMBL3814576) Show SMILES COCCOc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18Cl2N4O3/c1-27-10-11-28-19-23-18(13-2-4-14(21)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-20/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 10 to 1000 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyph...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260194 (US9504692, 4090) Show SMILES COc1ccc2N(CC3CCCN(C)C3)c3ccccc3Sc2c1 Show InChI InChI=1S/C20H24N2OS/c1-21-11-5-6-15(13-21)14-22-17-7-3-4-8-19(17)24-20-12-16(23-2)9-10-18(20)22/h3-4,7-10,12,15H,5-6,11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260191 (US9504692, 4124) Show SMILES CN1CCCC(CN2c3ccccc3Sc3cc(C)ccc23)C1 Show InChI InChI=1S/C20H24N2S/c1-15-9-10-18-20(12-15)23-19-8-4-3-7-17(19)22(18)14-16-6-5-11-21(2)13-16/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.85E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260191 (US9504692, 4124) Show SMILES CN1CCCC(CN2c3ccccc3Sc3cc(C)ccc23)C1 Show InChI InChI=1S/C20H24N2S/c1-15-9-10-18-20(12-15)23-19-8-4-3-7-17(19)22(18)14-16-6-5-11-21(2)13-16/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.85E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260190 (US9504692, 3998) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccc(Cl)cc23)C1 Show InChI InChI=1S/C19H21ClN2S/c1-21-10-4-5-14(12-21)13-22-16-6-2-3-7-18(16)23-19-9-8-15(20)11-17(19)22/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177471 (CHEMBL3813831) Show SMILES COCCOc1nc(-c2ccc(Br)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18BrClN4O3/c1-27-10-11-28-19-23-18(13-2-4-14(20)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-21/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 1 to 100 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyphen...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177471 (CHEMBL3813831) Show SMILES COCCOc1nc(-c2ccc(Br)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18BrClN4O3/c1-27-10-11-28-19-23-18(13-2-4-14(20)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-21/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 1 to 100 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyphen...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260189 (US9504692, 3997) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)C1 Show InChI InChI=1S/C20H21F3N2S/c1-24-10-4-5-14(12-24)13-25-16-6-2-3-7-18(16)26-19-9-8-15(11-17(19)25)20(21,22)23/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260192 (US9504692, 4058) Show SMILES CN1CCCC(CN2c3ccccc3Sc3cc(ccc23)C(F)(F)F)C1 Show InChI InChI=1S/C20H21F3N2S/c1-24-10-4-5-14(12-24)13-25-16-6-2-3-7-18(16)26-19-11-15(20(21,22)23)8-9-17(19)25/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260180 (US9504692, 4020) Show SMILES CN1CCCCC1CN1c2ccccc2Sc2ccccc12 Show InChI InChI=1S/C19H22N2S/c1-20-13-7-6-8-15(20)14-21-16-9-2-4-11-18(16)22-19-12-5-3-10-17(19)21/h2-5,9-12,15H,6-8,13-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260164 (US9504692, 3950) Show SMILES C(CN1CCCC1)CN1c2ccccc2Sc2ccccc12 Show InChI InChI=1S/C19H22N2S/c1-3-10-18-16(8-1)21(15-7-14-20-12-5-6-13-20)17-9-2-4-11-19(17)22-18/h1-4,8-11H,5-7,12-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.67E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260177 (US9504692, 4037) Show SMILES C(N1c2ccccc2Sc2ccccc12)c1ccccc1 Show InChI InChI=1S/C19H15NS/c1-2-8-15(9-3-1)14-20-16-10-4-6-12-18(16)21-19-13-7-5-11-17(19)20/h1-13H,14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	2.67E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260173 (US9504692, 3949) Show SMILES CC(C)N1CCCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C21H26N2S/c1-16(2)22-13-7-8-17(14-22)15-23-18-9-3-5-11-20(18)24-21-12-6-4-10-19(21)23/h3-6,9-12,16-17H,7-8,13-15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.77E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177153 (CHEMBL3814576) Show SMILES COCCOc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18Cl2N4O3/c1-27-10-11-28-19-23-18(13-2-4-14(21)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-20/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 1 to 100 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyphen...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50177153 (CHEMBL3814576) Show SMILES COCCOc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(NC(=O)CCl)cc1 Show InChI InChI=1S/C19H18Cl2N4O3/c1-27-10-11-28-19-23-18(13-2-4-14(21)5-3-13)25(24-19)16-8-6-15(7-9-16)22-17(26)12-20/h2-9H,10-12H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant Malt1 (unknown origin) at 1 to 100 uM preincubated for 1 hr followed by (S)-1-((6-(4-(4-(5,5-Difluoro-3,7-bis(4-methoxyphen...				Bioorg Med Chem 24: 3312-29 (2016) Article DOI: 10.1016/j.bmc.2016.03.035 BindingDB Entry DOI: 10.7270/Q21G0P58
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50002338 ((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...) Show SMILES CSc1ccc2Sc3ccccc3N(CCC3CCCCN3C)c2c1 Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	PDB US Patent	n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260196 (US9504692, 4097) Show SMILES CN1CCCC(CN2c3ccccc3Sc3c(C)cc(C)cc23)C1 Show InChI InChI=1S/C21H26N2S/c1-15-11-16(2)21-19(12-15)23(14-17-7-6-10-22(3)13-17)18-8-4-5-9-20(18)24-21/h4-5,8-9,11-12,17H,6-7,10,13-14H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.86E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260188 (US9504692, 4097) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccc(C)cc23)C1 Show InChI InChI=1S/C20H24N2S/c1-15-9-10-20-18(12-15)22(14-16-6-5-11-21(2)13-16)17-7-3-4-8-19(17)23-20/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.88E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM50408503 (CHEMBL38659 | US9504692, 3918) Show SMILES CNCCCN1c2ccccc2Sc2ccccc12 Show InChI InChI=1S/C16H18N2S/c1-17-11-6-12-18-13-7-2-4-9-15(13)19-16-10-5-3-8-14(16)18/h2-5,7-10,17H,6,11-12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260189 (US9504692, 3997) Show SMILES CN1CCCC(CN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)C1 Show InChI InChI=1S/C20H21F3N2S/c1-24-10-4-5-14(12-24)13-25-16-6-2-3-7-18(16)26-19-9-8-15(11-17(19)25)20(21,22)23/h2-3,6-9,11,14H,4-5,10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.17E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260195 (US9504692, 4088) Show SMILES CN1CCCC(CN2c3ccccc3Sc3cc(ccc23)C(C)=O)C1 Show InChI InChI=1S/C21H24N2OS/c1-15(24)17-9-10-19-21(12-17)25-20-8-4-3-7-18(20)23(19)14-16-6-5-11-22(2)13-16/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.22E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260162 (US9504692, 3939) Show SMILES CCN(CC)CCCN1c2ccccc2Sc2ccccc12 Show InChI InChI=1S/C19H24N2S/c1-3-20(4-2)14-9-15-21-16-10-5-7-12-18(16)22-19-13-8-6-11-17(19)21/h5-8,10-13H,3-4,9,14-15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM260176 (US9504692, 3975) Show SMILES C(N1c2ccccc2Sc2ccccc12)c1cccnc1 Show InChI InChI=1S/C18H14N2S/c1-3-9-17-15(7-1)20(13-14-6-5-11-19-12-14)16-8-2-4-10-18(16)21-17/h1-12H,13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.75E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM67545 (N,N-dimethyl-3-(10-phenothiazinyl)-1-propanamine;h...) Show SMILES CN(C)CCCN1c2ccccc2Sc2ccccc12 Show InChI InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	US Patent	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair
Glutathione S-transferase P/Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM81470 (CAS_14677 | Methdilazine | NSC_14677 | US9504692, ...) Show SMILES CN1CCC(CN2c3ccccc3Sc3ccccc23)C1 Show InChI InChI=1S/C18H20N2S/c1-19-11-10-14(12-19)13-20-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)20/h2-9,14H,10-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	6.25E+3	n/a	n/a	n/a	n/a	n/a	30
HELMHOLTZ ZENTRUM MUNCHEN, DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) US Patent					Assay Description To screen for small molecular weight compounds that can inhibit MALT1 protease activity, recombinant GSTMALT1 was purified from E. coli to establish ...				US Patent US9504692 (2016) BindingDB Entry DOI: 10.7270/Q21C1VSR
					More data for this Ligand-Target Pair

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