Compile Data Set for Download or QSAR

Found 14 hits of ic50 data for polymerid = 9785   

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
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228602 (US9340573, 13) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNc2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C23H31N5O2/c1-15(2)20(27-22(29)16(3)24-4)23(30)28-19(13-17-9-8-12-25-21(17)28)14-26-18-10-6-5-7-11-18/h5-12,15-16,19-20,24,26H,13-14H2,1-4H3,(H,27,29)/t16-,19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.307	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228603 (US9340573, 14) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNc2ccc3ccccc3c2)Cc2cccnc12 Show InChI InChI=1S/C27H33N5O2/c1-17(2)24(31-26(33)18(3)28-4)27(34)32-23(15-21-10-7-13-29-25(21)32)16-30-22-12-11-19-8-5-6-9-20(19)14-22/h5-14,17-18,23-24,28,30H,15-16H2,1-4H3,(H,31,33)/t18-,23-,24-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.506	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228599 (US9340573, 10) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNS(=O)(=O)c2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C23H31N5O4S/c1-15(2)20(27-22(29)16(3)24-4)23(30)28-18(13-17-9-8-12-25-21(17)28)14-26-33(31,32)19-10-6-5-7-11-19/h5-12,15-16,18,20,24,26H,13-14H2,1-4H3,(H,27,29)/t16-,18-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.820	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228590 (US9340573, 1) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)c2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C24H31N5O3/c1-15(2)20(28-22(30)16(3)25-4)24(32)29-19(13-18-11-8-12-26-21(18)29)14-27-23(31)17-9-6-5-7-10-17/h5-12,15-16,19-20,25H,13-14H2,1-4H3,(H,27,31)(H,28,30)/t16-,19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.888	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228600 (US9340573, 11) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)OCc2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C25H33N5O4/c1-16(2)21(29-23(31)17(3)26-4)24(32)30-20(13-19-11-8-12-27-22(19)30)14-28-25(33)34-15-18-9-6-5-7-10-18/h5-12,16-17,20-21,26H,13-15H2,1-4H3,(H,28,33)(H,29,31)/t17-,20-,21-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.05	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228598 (US9340573, 9) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNS(C)(=O)=O)Cc2cccnc12 Show InChI InChI=1S/C18H29N5O4S/c1-11(2)15(22-17(24)12(3)19-4)18(25)23-14(10-21-28(5,26)27)9-13-7-6-8-20-16(13)23/h6-8,11-12,14-15,19,21H,9-10H2,1-5H3,(H,22,24)/t12-,14-,15-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.24	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228596 (US9340573, 7) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Nc2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C24H32N6O3/c1-15(2)20(29-22(31)16(3)25-4)23(32)30-19(13-17-9-8-12-26-21(17)30)14-27-24(33)28-18-10-6-5-7-11-18/h5-12,15-16,19-20,25H,13-14H2,1-4H3,(H,29,31)(H2,27,28,33)/t16-,19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.54	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228593 (US9340573, 4) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Cc2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C25H33N5O3/c1-16(2)22(29-24(32)17(3)26-4)25(33)30-20(14-19-11-8-12-27-23(19)30)15-28-21(31)13-18-9-6-5-7-10-18/h5-12,16-17,20,22,26H,13-15H2,1-4H3,(H,28,31)(H,29,32)/t17-,20-,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.57	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228601 (US9340573, 12) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Oc2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C24H31N5O4/c1-15(2)20(28-22(30)16(3)25-4)23(31)29-18(13-17-9-8-12-26-21(17)29)14-27-24(32)33-19-10-6-5-7-11-19/h5-12,15-16,18,20,25H,13-14H2,1-4H3,(H,27,32)(H,28,30)/t16-,18-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.62	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228594 (US9340573, 5) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)OC)Cc2cccnc12 Show InChI InChI=1S/C19H29N5O4/c1-11(2)15(23-17(25)12(3)20-4)18(26)24-14(10-22-19(27)28-5)9-13-7-6-8-21-16(13)24/h6-8,11-12,14-15,20H,9-10H2,1-5H3,(H,22,27)(H,23,25)/t12-,14-,15-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.67	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228597 (US9340573, 8) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)[C@@H](C)c2ccccc2)Cc2cccnc12 Show InChI InChI=1S/C26H35N5O3/c1-16(2)22(30-25(33)18(4)27-5)26(34)31-21(14-20-12-9-13-28-23(20)31)15-29-24(32)17(3)19-10-7-6-8-11-19/h6-13,16-18,21-22,27H,14-15H2,1-5H3,(H,29,32)(H,30,33)/t17-,18-,21-,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.56	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228591 (US9340573, 2) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(C)=O)Cc2cccnc12 Show InChI InChI=1S/C19H29N5O3/c1-11(2)16(23-18(26)12(3)20-5)19(27)24-15(10-22-13(4)25)9-14-7-6-8-21-17(14)24/h6-8,11-12,15-16,20H,9-10H2,1-5H3,(H,22,25)(H,23,26)/t12-,15-,16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.67	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228592 (US9340573, 3) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)NC)Cc2cccnc12 Show InChI InChI=1S/C19H30N6O3/c1-11(2)15(24-17(26)12(3)20-4)18(27)25-14(10-23-19(28)21-5)9-13-7-6-8-22-16(13)25/h6-8,11-12,14-15,20H,9-10H2,1-5H3,(H,24,26)(H2,21,23,28)/t12-,14-,15-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.88	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [124-240] (Artificial Sequence)	BDBM228595 (US9340573, 6) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)N(C)C)Cc2cccnc12 Show InChI InChI=1S/C20H32N6O3/c1-12(2)16(24-18(27)13(3)21-4)19(28)26-15(11-23-20(29)25(5)6)10-14-8-7-9-22-17(14)26/h7-9,12-13,15-16,21H,10-11H2,1-6H3,(H,23,29)(H,24,27)/t13-,15-,16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.17	n/a	n/a	n/a	n/a	7.5	37
Hoffmann-La Roche Inc. US Patent					Assay Description The peptide AVPIAQKSEK-(ε-biotin)-OH 1:2 TFA ("Peptide A") was identified as a substrate for the TR-FRET assay by screening the 6× Hist...				US Patent US9340573 (2016) BindingDB Entry DOI: 10.7270/Q2FJ2FNT
					More data for this Ligand-Target Pair