Compile Data Set for Download or QSAR

Found 20 hits of ic50 for UniProtKB: P31749   

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
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223474 (US9320734, 415) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3c(C)noc3C)cc2)nc(OC)n1 Show InChI InChI=1S/C17H19N5O7S2/c1-10-16(11(2)29-20-10)31(25,26)21-12-5-7-13(8-6-12)30(23,24)22-14-9-15(27-3)19-17(18-14)28-4/h5-9,21H,1-4H3,(H,18,19,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223476 (US9320734, 389) Show SMILES CC1=NN(C(=O)c2ccc(Cl)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1 |t:1| Show InChI InChI=1S/C20H16ClN7O4S2/c1-11-17(19(30)28(26-11)18(29)13-3-5-14(21)6-4-13)24-23-15-7-9-16(10-8-15)34(31,32)27-20-25-22-12(2)33-20/h3-10,17H,1-2H3,(H,25,27)/b24-23+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304369 (4-dodecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonam...) Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)27(24,25)23-20-22-21-17-26-20/h13-17H,2-12H2,1H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304368 (CHEMBL595582 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...) Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C18H26N4O3S2/c1-2-3-4-5-6-7-8-9-17(23)20-15-10-12-16(13-11-15)27(24,25)22-18-21-19-14-26-18/h10-14H,2-9H2,1H3,(H,20,23)(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304369 (4-dodecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonam...) Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)27(24,25)23-20-22-21-17-26-20/h13-17H,2-12H2,1H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304368 (CHEMBL595582 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...) Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C18H26N4O3S2/c1-2-3-4-5-6-7-8-9-17(23)20-15-10-12-16(13-11-15)27(24,25)22-18-21-19-14-26-18/h10-14H,2-9H2,1H3,(H,20,23)(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50034417 (4-Amino-N-[1,3,4]thiadiazol-2-yl-benzenesulfonamid...) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C8H8N4O2S2/c9-6-1-3-7(4-2-6)16(13,14)12-8-11-10-5-15-8/h1-5H,9H2,(H,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50034417 (4-Amino-N-[1,3,4]thiadiazol-2-yl-benzenesulfonamid...) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C8H8N4O2S2/c9-6-1-3-7(4-2-6)16(13,14)12-8-11-10-5-15-8/h1-5H,9H2,(H,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223477 (US9320734, 316) Show SMILES CC1=NN(C(=O)c2ccc(Cl)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H16ClN7O4S/c1-13-18(20(31)29(27-13)19(30)14-3-5-15(22)6-4-14)26-25-16-7-9-17(10-8-16)34(32,33)28-21-23-11-2-12-24-21/h2-12,18H,1H3,(H,23,24,28)/b26-25+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304367 (CHEMBL595786 | N-(4-(N-(5-methyl-1,3,4-thiadiazol-...) Show SMILES Cc1nnc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc2)s1 Show InChI InChI=1S/C19H16N4O4S3/c1-13-20-21-19(28-13)23-29(24,25)17-10-7-16(8-11-17)22-30(26,27)18-9-6-14-4-2-3-5-15(14)12-18/h2-12,22H,1H3,(H,21,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	US Patent	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223482 (US9320734, 441) Show SMILES CCOc1ccccc1C(=O)Nc1ccccc1C(O)=O Show InChI InChI=1S/C16H15NO4/c1-2-21-14-10-6-4-8-12(14)15(18)17-13-9-5-3-7-11(13)16(19)20/h3-10H,2H2,1H3,(H,17,18)(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50034417 (4-Amino-N-[1,3,4]thiadiazol-2-yl-benzenesulfonamid...) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C8H8N4O2S2/c9-6-1-3-7(4-2-6)16(13,14)12-8-11-10-5-15-8/h1-5H,9H2,(H,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304371 (CHEMBL611216 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...) Show SMILES COCCOCCOCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C15H20N4O6S2/c1-23-6-7-24-8-9-25-10-14(20)17-12-2-4-13(5-3-12)27(21,22)19-15-18-16-11-26-15/h2-5,11H,6-10H2,1H3,(H,17,20)(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM50304370 (CHEMBL593946 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...) Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1 Show InChI InChI=1S/C10H10N4O3S2/c1-7(15)12-8-2-4-9(5-3-8)19(16,17)14-10-13-11-6-18-10/h2-6H,1H3,(H,12,15)(H,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223485 (US9320734, 456) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C14H14N6O6S4/c15-9-1-5-11(6-2-9)29(23,24)19-10-3-7-12(8-4-10)30(25,26)20-13-17-18-14(27-13)28(16,21)22/h1-8,19H,15H2,(H,17,20)(H2,16,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223484 (US9320734, 450) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc(OC)n1 Show InChI InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-12-8-13(22-2)17-14(16-12)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223483 (US9320734, 445) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)nc(OC)n1 Show InChI InChI=1S/C17H16N4O6S/c1-25-15-10-14(19-17(20-15)26-2)21-28(23,24)12-7-5-11(6-8-12)18-16(22)13-4-3-9-27-13/h3-10H,1-2H3,(H,18,22)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223473 (US9320734, 444) Show SMILES COc1cc(NS(=O)(=O)c2ccc(Nc3ccco3)cc2)nc(OC)n1 Show InChI InChI=1S/C16H16N4O5S/c1-23-15-10-13(18-16(19-15)24-2)20-26(21,22)12-7-5-11(6-8-12)17-14-4-3-9-25-14/h3-10,17H,1-2H3,(H,18,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223481 (US9320734, 439) Show SMILES OC(=O)c1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccccc1 Show InChI InChI=1S/C21H16N2O4/c24-19(15-10-4-5-11-16(15)21(26)27)23-18-13-7-6-12-17(18)20(25)22-14-8-2-1-3-9-14/h1-13H,(H,22,25)(H,23,24)(H,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blotting using specific antibodies against phospho-Ser473-AKT in MiaPaCa-2 cells.Inhibition of AKT was meas...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase [1-123] (Homo sapiens (Human))	BDBM223475 (US9320734, 345) Show SMILES NS(=O)(=O)c1nnc(NS(=O)(=O)c2cccc3cccnc23)s1 Show InChI InChI=1S/C11H9N5O4S3/c12-22(17,18)11-15-14-10(21-11)16-23(19,20)8-5-1-3-7-4-2-6-13-9(7)8/h1-6H,(H,14,16)(H2,12,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System; Arizona Board of Regents on behalf of the University of Arizona US Patent					Assay Description Inhibition of AKT was measured by Western blots using specific antibodies against phospho-Ser473-AKT in HT-29 lung cancer cells. Inhibition of the ph...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair