Compile Data Set for Download or QSAR

Found 23 hits of ec50 data for polymerid = 396   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212756 (US9556111, Table 1.22) Show SMILES CN(C)c1ccc(C[NH+](Cc2ccccc2)Cc2ccc(cc2)N(C)C)cc1 Show InChI InChI=1S/C25H31N3/c1-26(2)24-14-10-22(11-15-24)19-28(18-21-8-6-5-7-9-21)20-23-12-16-25(17-13-23)27(3)4/h5-17H,18-20H2,1-4H3/p+1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212758 (US9556111, Table 1.23) Show SMILES Cc1ccc(NC(=O)Nc2ccc(CN(Cc3ccccc3)Cc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)cc2)cc1 Show InChI InChI=1S/C37H37N5O2/c1-27-8-16-32(17-9-27)38-36(43)40-34-20-12-30(13-21-34)25-42(24-29-6-4-3-5-7-29)26-31-14-22-35(23-15-31)41-37(44)39-33-18-10-28(2)11-19-33/h3-23H,24-26H2,1-2H3,(H2,38,40,43)(H2,39,41,44)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212733 (US9556111, Table 1.19) Show SMILES CCN(CC)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)N(CC)CC)cc1 Show InChI InChI=1S/C29H39N3/c1-5-31(6-2)28-18-14-26(15-19-28)23-30(22-25-12-10-9-11-13-25)24-27-16-20-29(21-17-27)32(7-3)8-4/h9-21H,5-8,22-24H2,1-4H3	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212731 (US9556111, Table 1.18) Show SMILES O=C(Nc1ccccc1)Nc1ccc(CN(Cc2ccccc2)Cc2ccc(NC(=O)Nc3ccccc3)cc2)cc1 Show InChI InChI=1S/C35H33N5O2/c41-34(36-30-12-6-2-7-13-30)38-32-20-16-28(17-21-32)25-40(24-27-10-4-1-5-11-27)26-29-18-22-33(23-19-29)39-35(42)37-31-14-8-3-9-15-31/h1-23H,24-26H2,(H2,36,38,41)(H2,37,39,42)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212727 (US9556111, Table 1.17) Show SMILES Nc1ccc(CN(Cc2ccccc2)Cc2ccc(N)cc2)cc1 Show InChI InChI=1S/C21H23N3/c22-20-10-6-18(7-11-20)15-24(14-17-4-2-1-3-5-17)16-19-8-12-21(23)13-9-19/h1-13H,14-16,22-23H2	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212735 (US9556111, Table 1.20) Show SMILES Cc1ccc(NC(=O)Nc2ccc(CN(Cc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)Cc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)cc2)cc1 Show InChI InChI=1S/C45H45N7O3/c1-31-4-16-37(17-5-31)46-43(53)49-40-22-10-34(11-23-40)28-52(29-35-12-24-41(25-13-35)50-44(54)47-38-18-6-32(2)7-19-38)30-36-14-26-42(27-15-36)51-45(55)48-39-20-8-33(3)9-21-39/h4-27H,28-30H2,1-3H3,(H2,46,49,53)(H2,47,50,54)(H2,48,51,55)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212718 (US9556111, Table 1.14) Show SMILES [O-][N+](=O)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H19N3O4/c25-23(26)20-10-6-18(7-11-20)15-22(14-17-4-2-1-3-5-17)16-19-8-12-21(13-9-19)24(27)28/h1-13H,14-16H2	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212725 (US9556111, Table 1.16) Show SMILES Fc1ccc(NC(=O)Nc2ccc(CN(Cc3ccccc3)Cc3ccc(NC(=O)Nc4ccc(F)cc4)cc3)cc2)cc1 Show InChI InChI=1S/C35H31F2N5O2/c36-28-10-18-32(19-11-28)40-34(43)38-30-14-6-26(7-15-30)23-42(22-25-4-2-1-3-5-25)24-27-8-16-31(17-9-27)39-35(44)41-33-20-12-29(37)13-21-33/h1-21H,22-24H2,(H2,38,40,43)(H2,39,41,44)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212599 (US9556111, Table 1.5) Show SMILES OC(=O)c1csc(CN(CCC(c2ccccc2)c2ccccc2)Cc2ccccc2F)n1 Show InChI InChI=1S/C27H25FN2O2S/c28-24-14-8-7-13-22(24)17-30(18-26-29-25(19-33-26)27(31)32)16-15-23(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,23H,15-18H2,(H,31,32)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212603 (US9556111, Table 1.7) Show SMILES OC(=O)c1csc(CN(CCC(c2ccccc2)c2ccccc2)Cc2ccc(F)cc2)n1 Show InChI InChI=1S/C27H25FN2O2S/c28-23-13-11-20(12-14-23)17-30(18-26-29-25(19-33-26)27(31)32)16-15-24(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,24H,15-18H2,(H,31,32)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212709 (US9556111, Table 1.9) Show SMILES CC(C)(C)c1ccc(CN(CCC(c2ccccc2)c2ccccc2)Cc2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C31H34N2O2S/c1-31(2,3)26-16-14-23(15-17-26)20-33(21-29-32-28(22-36-29)30(34)35)19-18-27(24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-17,22,27H,18-21H2,1-3H3,(H,34,35)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212738 (US9556111, Table 1.21) Show SMILES [NH3+]c1ccc(C[NH+](Cc2ccc([NH3+])cc2)Cc2ccc([NH3+])cc2)cc1 Show InChI InChI=1S/C21H24N4/c22-19-7-1-16(2-8-19)13-25(14-17-3-9-20(23)10-4-17)15-18-5-11-21(24)12-6-18/h1-12H,13-15,22-24H2/p+4	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.22E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212712 (US9556111, Table 1.11) Show SMILES COc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1 Show InChI InChI=1S/C20H19FN2O3S/c1-26-17-8-4-15(5-9-17)11-23(10-14-2-6-16(21)7-3-14)12-19-22-18(13-27-19)20(24)25/h2-9,13H,10-12H2,1H3,(H,24,25)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.56E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212722 (US9556111, Table 1.15) Show SMILES OC(=O)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)C(O)=O)cc1 Show InChI InChI=1S/C23H21NO4/c25-22(26)20-10-6-18(7-11-20)15-24(14-17-4-2-1-3-5-17)16-19-8-12-21(13-9-19)23(27)28/h1-13H,14-16H2,(H,25,26)(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.96E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212716 (US9556111, Table 1.13) Show SMILES Cc1ccc(CN(CCC(c2ccccc2)c2ccccc2)Cc2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C28H28N2O2S/c1-21-12-14-22(15-13-21)18-30(19-27-29-26(20-33-27)28(31)32)17-16-25(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-15,20,25H,16-19H2,1H3,(H,31,32)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.54E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212594 (US9556111, Table 1.2) Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2cccc(Cl)c2)n1 Show InChI InChI=1S/C19H16ClFN2O2S/c20-15-3-1-2-14(8-15)10-23(9-13-4-6-16(21)7-5-13)11-18-22-17(12-26-18)19(24)25/h1-8,12H,9-11H2,(H,24,25)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.64E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212597 (US9556111, Table 1.4) Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2ccc(OCc3ccccc3)cc2)n1 Show InChI InChI=1S/C26H23FN2O3S/c27-22-10-6-19(7-11-22)14-29(16-25-28-24(18-33-25)26(30)31)15-20-8-12-23(13-9-20)32-17-21-4-2-1-3-5-21/h1-13,18H,14-17H2,(H,30,31)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.95E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212592 (US9556111, Table 1.1) Show SMILES CC(C)(C)c1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1 Show InChI InChI=1S/C23H25FN2O2S/c1-23(2,3)18-8-4-16(5-9-18)12-26(13-17-6-10-19(24)11-7-17)14-21-25-20(15-29-21)22(27)28/h4-11,15H,12-14H2,1-3H3,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.16E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212601 (US9556111, Table 1.6) Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2cccc(c2)C(F)(F)F)n1 Show InChI InChI=1S/C20H16F4N2O2S/c21-16-6-4-13(5-7-16)9-26(11-18-25-17(12-29-18)19(27)28)10-14-2-1-3-15(8-14)20(22,23)24/h1-8,12H,9-11H2,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	6.05E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212707 (US9556111, Table 1.8) Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2ccc(Cl)cc2)n1 Show InChI InChI=1S/C19H16ClFN2O2S/c20-15-5-1-13(2-6-15)9-23(10-14-3-7-16(21)8-4-14)11-18-22-17(12-26-18)19(24)25/h1-8,12H,9-11H2,(H,24,25)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	9.43E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212711 (US9556111, Table 1.10) Show SMILES Cc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2cccc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C21H19F3N2O2S/c1-14-5-7-15(8-6-14)10-26(12-19-25-18(13-29-19)20(27)28)11-16-3-2-4-17(9-16)21(22,23)24/h2-9,13H,10-12H2,1H3,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	9.83E+4	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212595 (US9556111, Table 1.3) Show SMILES Cc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1 Show InChI InChI=1S/C20H19FN2O2S/c1-14-2-4-15(5-3-14)10-23(11-16-6-8-17(21)9-7-16)12-19-22-18(13-26-19)20(24)25/h2-9,13H,10-12H2,1H3,(H,24,25)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.37E+5	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma (Human)	BDBM212714 (US9556111, Table 1.12) Show SMILES OC(=O)c1csc(CN(Cc2cccc(c2)C(F)(F)F)Cc2ccccc2F)n1 Show InChI InChI=1S/C20H16F4N2O2S/c21-16-7-2-1-5-14(16)10-26(11-18-25-17(12-29-18)19(27)28)9-13-4-3-6-15(8-13)20(22,23)24/h1-8,12H,9-11H2,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.16E+5	n/a	n/a	n/a	n/a
UNIVERSITETET I OSLO US Patent					Assay Description Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...				US Patent US9556111 (2017)
					More data for this Ligand-Target Pair