Compile Data Set for Download or QSAR

Found 34 hits with Last Name = 'jan sterk' and Initial = 'g'   

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
Phosphodiesterase (Trypanosoma brucei)	BDBM50453161 (CHEMBL4204999) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C27H30N4O4/c1-16(2)31-27(34)21-7-5-4-6-20(21)25(30-31)19-12-13-23(35-3)22(14-19)17-8-10-18(11-9-17)26(33)29-15-24(28)32/h4-5,8-14,16,20-21H,6-7,15H2,1-3H3,(H2,28,32)(H,29,33)/t20-,21+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair				3D Structure (crystal)
Phosphodiesterase (Trypanosoma brucei)	BDBM50453158 (CHEMBL4210475) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C31H36N4O4/c1-39-27-17-16-22(18-26(27)20-12-14-21(15-13-20)30(37)33-19-28(32)36)29-24-10-6-7-11-25(24)31(38)35(34-29)23-8-4-2-3-5-9-23/h6-7,12-18,23-25H,2-5,8-11,19H2,1H3,(H2,32,36)(H,33,37)/t24-,25+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair				3D Structure (crystal)
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50512592 (CHEMBL4465919) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(N)=O |r,c:3,9| Show InChI InChI=1S/C25H29N3O3/c1-31-22-14-12-18(16-17(22)13-15-23(26)29)24-20-10-6-7-11-21(20)25(30)28(27-24)19-8-4-2-3-5-9-19/h6-7,12,14,16,19-21H,2-5,8-11H2,1H3,(H2,26,29)/t20-,21+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50512604 (CHEMBL4464777) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCc1ccco1 |r,c:3,9| Show InChI InChI=1S/C30H33N3O4/c1-36-27-16-14-22(19-21(27)15-17-28(34)31-20-24-11-8-18-37-24)29-25-12-6-7-13-26(25)30(35)33(32-29)23-9-4-2-3-5-10-23/h6-8,11,14,16,18-19,23,25-26H,2-5,9-10,12-13,20H2,1H3,(H,31,34)/t25-,26+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512601 (CHEMBL4519708) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCCCC |r,c:3,9| Show InChI InChI=1S/C29H37N3O3/c1-3-4-19-30-27(33)18-16-21-20-22(15-17-26(21)35-2)28-24-13-9-10-14-25(24)29(34)32(31-28)23-11-7-5-6-8-12-23/h9-10,15,17,20,23-25H,3-8,11-14,19H2,1-2H3,(H,30,33)/t24-,25+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512604 (CHEMBL4464777) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCc1ccco1 |r,c:3,9| Show InChI InChI=1S/C30H33N3O4/c1-36-27-16-14-22(19-21(27)15-17-28(34)31-20-24-11-8-18-37-24)29-25-12-6-7-13-26(25)30(35)33(32-29)23-9-4-2-3-5-10-23/h6-8,11,14,16,18-19,23,25-26H,2-5,9-10,12-13,20H2,1H3,(H,31,34)/t25-,26+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair				3D Structure (crystal)
Phosphodiesterase (Trypanosoma brucei)	BDBM50512602 (CHEMBL4473824) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C27H32N4O4/c1-35-23-14-12-19(16-18(23)13-15-25(33)29-17-24(28)32)26-21-10-6-7-11-22(21)27(34)31(30-26)20-8-4-2-3-5-9-20/h6-7,12,14,16,20-22H,2-5,8-11,17H2,1H3,(H2,28,32)(H,29,33)/t21-,22+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512592 (CHEMBL4465919) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(N)=O |r,c:3,9| Show InChI InChI=1S/C25H29N3O3/c1-31-22-14-12-18(16-17(22)13-15-23(26)29)24-20-10-6-7-11-21(20)25(30)28(27-24)19-8-4-2-3-5-9-19/h6-7,12,14,16,19-21H,2-5,8-11H2,1H3,(H2,26,29)/t20-,21+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair				3D Structure (crystal)
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50512601 (CHEMBL4519708) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCCCC |r,c:3,9| Show InChI InChI=1S/C29H37N3O3/c1-3-4-19-30-27(33)18-16-21-20-22(15-17-26(21)35-2)28-24-13-9-10-14-25(24)29(34)32(31-28)23-11-7-5-6-8-12-23/h9-10,15,17,20,23-25H,3-8,11-14,19H2,1-2H3,(H,30,33)/t24-,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512607 (CHEMBL4520514) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCCOC |r,c:3,9| Show InChI InChI=1S/C28H35N3O4/c1-34-18-17-29-26(32)16-14-20-19-21(13-15-25(20)35-2)27-23-11-7-8-12-24(23)28(33)31(30-27)22-9-5-3-4-6-10-22/h7-8,13,15,19,22-24H,3-6,9-12,17-18H2,1-2H3,(H,29,32)/t23-,24+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512608 (CHEMBL4556148) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(C(=O)NCC(N)=O)c(F)c1 |r,c:3,9| Show InChI InChI=1S/C31H35FN4O4/c1-40-27-15-13-20(16-25(27)19-12-14-24(26(32)17-19)30(38)34-18-28(33)37)29-22-10-6-7-11-23(22)31(39)36(35-29)21-8-4-2-3-5-9-21/h6-7,12-17,21-23H,2-5,8-11,18H2,1H3,(H2,33,37)(H,34,38)/t22-,23+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512614 (CHEMBL4467085) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)N1CCOCC1 |r,c:3,9| Show InChI InChI=1S/C29H35N3O4/c1-35-26-14-12-22(20-21(26)13-15-27(33)31-16-18-36-19-17-31)28-24-10-6-7-11-25(24)29(34)32(30-28)23-8-4-2-3-5-9-23/h6-7,12,14,20,23-25H,2-5,8-11,16-19H2,1H3/t24-,25+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50453158 (CHEMBL4210475) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C31H36N4O4/c1-39-27-17-16-22(18-26(27)20-12-14-21(15-13-20)30(37)33-19-28(32)36)29-24-10-6-7-11-25(24)31(38)35(34-29)23-8-4-2-3-5-9-23/h6-7,12-18,23-25H,2-5,8-11,19H2,1H3,(H2,32,36)(H,33,37)/t24-,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512610 (CHEMBL4551476) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc2C(=O)N(CC(N)=O)Cc2c1 |r,c:3,9| Show InChI InChI=1S/C32H36N4O4/c1-40-28-15-13-21(17-27(28)20-12-14-24-22(16-20)18-35(31(24)38)19-29(33)37)30-25-10-6-7-11-26(25)32(39)36(34-30)23-8-4-2-3-5-9-23/h6-7,12-17,23,25-26H,2-5,8-11,18-19H2,1H3,(H2,33,37)/t25-,26+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512595 (CHEMBL4441002) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc2C(=O)N(CCOC)Cc2c1 |r,c:3,9| Show InChI InChI=1S/C33H39N3O4/c1-39-18-17-35-21-24-19-22(13-15-26(24)32(35)37)29-20-23(14-16-30(29)40-2)31-27-11-7-8-12-28(27)33(38)36(34-31)25-9-5-3-4-6-10-25/h7-8,13-16,19-20,25,27-28H,3-6,9-12,17-18,21H2,1-2H3/t27-,28+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50512607 (CHEMBL4520514) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#CC(=O)NCCOC |r,c:3,9| Show InChI InChI=1S/C28H35N3O4/c1-34-18-17-29-26(32)16-14-20-19-21(13-15-25(20)35-2)27-23-11-7-8-12-24(23)28(33)31(30-27)22-9-5-3-4-6-10-22/h7-8,13,15,19,22-24H,3-6,9-12,17-18H2,1-2H3,(H,29,32)/t23-,24+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512605 (CHEMBL4543722) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc2C(=O)NCc2c1 |r,c:3,9| Show InChI InChI=1S/C30H33N3O3/c1-36-27-15-13-20(17-26(27)19-12-14-23-21(16-19)18-31-29(23)34)28-24-10-6-7-11-25(24)30(35)33(32-28)22-8-4-2-3-5-9-22/h6-7,12-17,22,24-25H,2-5,8-11,18H2,1H3,(H,31,34)/t24-,25+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512615 (CHEMBL4587960) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(C(=O)NCC(N)=O)c(C)c1 |r,c:3,9| Show InChI InChI=1S/C32H38N4O4/c1-20-17-21(13-15-24(20)31(38)34-19-29(33)37)27-18-22(14-16-28(27)40-2)30-25-11-7-8-12-26(25)32(39)36(35-30)23-9-5-3-4-6-10-23/h7-8,13-18,23,25-26H,3-6,9-12,19H2,1-2H3,(H2,33,37)(H,34,38)/t25-,26+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512593 (CHEMBL4573706) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1F)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C31H35FN4O4/c1-40-27-15-13-19(16-25(27)22-14-12-20(17-26(22)32)30(38)34-18-28(33)37)29-23-10-6-7-11-24(23)31(39)36(35-29)21-8-4-2-3-5-9-21/h6-7,12-17,21,23-24H,2-5,8-11,18H2,1H3,(H2,33,37)(H,34,38)/t23-,24+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B (Homo sapiens (Human))	BDBM50453161 (CHEMBL4204999) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C27H30N4O4/c1-16(2)31-27(34)21-7-5-4-6-20(21)25(30-31)19-12-13-23(35-3)22(14-19)17-8-10-18(11-9-17)26(33)29-15-24(28)32/h4-5,8-14,16,20-21H,6-7,15H2,1-3H3,(H2,28,32)(H,29,33)/t20-,21+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain incubated for 20 mins using cAMP as substrate by PDELight HTS cAMP phosphodiesterase Kit based luminometry				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512600 (CHEMBL4449673) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#C |r,c:3,9| Show InChI InChI=1S/C24H28N2O2/c1-3-17-16-18(14-15-22(17)28-2)23-20-12-8-9-13-21(20)24(27)26(25-23)19-10-6-4-5-7-11-19/h1,8-9,14-16,19-21H,4-7,10-13H2,2H3/t20-,21+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512609 (CHEMBL4544409) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(C(=O)NCC(N)=O)c(OC)c1 |r,c:3,9| Show InChI InChI=1S/C32H38N4O5/c1-40-27-16-14-21(17-26(27)20-13-15-25(28(18-20)41-2)31(38)34-19-29(33)37)30-23-11-7-8-12-24(23)32(39)36(35-30)22-9-5-3-4-6-10-22/h7-8,13-18,22-24H,3-6,9-12,19H2,1-2H3,(H2,33,37)(H,34,38)/t23-,24+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.31E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512594 (CHEMBL4573906) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1OC)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C32H38N4O5/c1-40-27-16-14-20(17-26(27)23-15-13-21(18-28(23)41-2)31(38)34-19-29(33)37)30-24-11-7-8-12-25(24)32(39)36(35-30)22-9-5-3-4-6-10-22/h7-8,13-18,22,24-25H,3-6,9-12,19H2,1-2H3,(H2,33,37)(H,34,38)/t24-,25+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512616 (CHEMBL4455736) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(s1)C(=O)NCc1ccco1 |r,c:3,9| Show InChI InChI=1S/C28H29N3O4S/c1-17(2)31-28(33)21-9-5-4-8-20(21)26(30-31)18-10-11-23(34-3)22(15-18)24-12-13-25(36-24)27(32)29-16-19-7-6-14-35-19/h4-7,10-15,17,20-21H,8-9,16H2,1-3H3,(H,29,32)/t20-,21+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512613 (CHEMBL4470700) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)-c1ccc(cc1C)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C32H38N4O4/c1-20-17-22(31(38)34-19-29(33)37)13-15-24(20)27-18-21(14-16-28(27)40-2)30-25-11-7-8-12-26(25)32(39)36(35-30)23-9-5-3-4-6-10-23/h7-8,13-18,23,25-26H,3-6,9-12,19H2,1-2H3,(H2,33,37)(H,34,38)/t25-,26+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512612 (CHEMBL4445851) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(c1)C#Cc1cnco1 |r,c:3,9| Show InChI InChI=1S/C27H29N3O3/c1-32-25-15-13-20(16-19(25)12-14-22-17-28-18-33-22)26-23-10-6-7-11-24(23)27(31)30(29-26)21-8-4-2-3-5-9-21/h6-7,13,15-18,21,23-24H,2-5,8-11H2,1H3/t23-,24+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512611 (CHEMBL4544549) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)N1CC(C1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C24H31N5O4/c1-14(2)29-24(32)18-7-5-4-6-17(18)22(27-29)15-8-9-20(33-3)19(10-15)28-12-16(13-28)23(31)26-11-21(25)30/h4-5,8-10,14,16-18H,6-7,11-13H2,1-3H3,(H2,25,30)(H,26,31)/t17-,18+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512606 (CHEMBL4541444) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(s1)C(=O)NCC(N)=O |r,c:3,9| Show InChI InChI=1S/C25H28N4O4S/c1-14(2)29-25(32)17-7-5-4-6-16(17)23(28-29)15-8-9-19(33-3)18(12-15)20-10-11-21(34-20)24(31)27-13-22(26)30/h4-5,8-12,14,16-17H,6-7,13H2,1-3H3,(H2,26,30)(H,27,31)/t16-,17+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512599 (CHEMBL4575728) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)N1CC(C1)C(=O)NCc1ccco1 |r,c:3,9| Show InChI InChI=1S/C27H32N4O4/c1-17(2)31-27(33)22-9-5-4-8-21(22)25(29-31)18-10-11-24(34-3)23(13-18)30-15-19(16-30)26(32)28-14-20-7-6-12-35-20/h4-7,10-13,17,19,21-22H,8-9,14-16H2,1-3H3,(H,28,32)/t21-,22+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512598 (CHEMBL4532826) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)N1CC(C1)C(=O)NCCCC |r,c:3,9| Show InChI InChI=1S/C26H36N4O3/c1-5-6-13-27-25(31)19-15-29(16-19)22-14-18(11-12-23(22)33-4)24-20-9-7-8-10-21(20)26(32)30(28-24)17(2)3/h7-8,11-12,14,17,19-21H,5-6,9-10,13,15-16H2,1-4H3,(H,27,31)/t20-,21+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512597 (CHEMBL4527191) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(s1)C(=O)NCCOC |r,c:3,9| Show InChI InChI=1S/C26H31N3O4S/c1-16(2)29-26(31)19-8-6-5-7-18(19)24(28-29)17-9-10-21(33-4)20(15-17)22-11-12-23(34-22)25(30)27-13-14-32-3/h5-6,9-12,15-16,18-19H,7-8,13-14H2,1-4H3,(H,27,30)/t18-,19+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512596 (CHEMBL4454672) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(s1)C(=O)NCCCC |r,c:3,9| Show InChI InChI=1S/C27H33N3O3S/c1-5-6-15-28-26(31)24-14-13-23(34-24)21-16-18(11-12-22(21)33-4)25-19-9-7-8-10-20(19)27(32)30(29-25)17(2)3/h7-8,11-14,16-17,19-20H,5-6,9-10,15H2,1-4H3,(H,28,31)/t19-,20+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512591 (CHEMBL4476056) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)-c1ccc(s1)C(N)=O |r,c:3,9| Show InChI InChI=1S/C23H25N3O3S/c1-13(2)26-23(28)16-7-5-4-6-15(16)21(25-26)14-8-9-18(29-3)17(12-14)19-10-11-20(30-19)22(24)27/h4-5,8-13,15-16H,6-7H2,1-3H3,(H2,24,27)/t15-,16+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair
Phosphodiesterase (Trypanosoma brucei)	BDBM50512603 (CHEMBL4544133) Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(c1)N1CC(C1)C(N)=O |r,c:3,9| Show InChI InChI=1S/C22H28N4O3/c1-13(2)26-22(28)17-7-5-4-6-16(17)20(24-26)14-8-9-19(29-3)18(10-14)25-11-15(12-25)21(23)27/h4-5,8-10,13,15-17H,6-7,11-12H2,1-3H3,(H2,23,27)/t16-,17+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD 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
Vrije Universiteit Amsterdam Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei PDEB1 catalytic domain (565 to 918 residues) expressed in Escherichia coli BL21 incubated for 20 mins using cAMP as ...				Bioorg Med Chem 27: 3998-4012 (2019) Article DOI: 10.1016/j.bmc.2019.06.027 BindingDB Entry DOI: 10.7270/Q23N26QR
					More data for this Ligand-Target Pair