Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with Target = 'Insulin receptor substrate 1'   

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
Insulin receptor substrate 1 (RAT)	BDBM86694 (N'-(3-Chloro-4-morpholinophenyl)-N-hydroxyform...) Show SMILES ONC=Nc1ccc(N2CCOCC2)c(Cl)c1 |w:3.3| Show InChI InChI=1S/C11H14ClN3O2/c12-10-7-9(13-8-14-16)1-2-11(10)15-3-5-17-6-4-15/h1-2,7-8,16H,3-6H2,(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by PDSP Ki Database									J Pharmacol Exp Ther 314: 77-85 (2005) Article DOI: 10.1124/jpet.105.083964 BindingDB Entry DOI: 10.7270/Q2MW2FQQ
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223486 (US9320734, 331) Show SMILES CC1=NN(C(=O)c2ccccc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H17N7O4S/c1-14-18(20(30)28(26-14)19(29)15-6-3-2-4-7-15)25-24-16-8-10-17(11-9-16)33(31,32)27-21-22-12-5-13-23-21/h2-13,18H,1H3,(H,22,23,27)/b25-24+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	2.40E+3	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223488 (US9320734, 332) Show SMILES CC1=NN(C(=O)c2ccc(cc2)C(C)(C)C)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C25H25N7O4S/c1-16-21(23(34)32(30-16)22(33)17-6-8-18(9-7-17)25(2,3)4)29-28-19-10-12-20(13-11-19)37(35,36)31-24-26-14-5-15-27-24/h5-15,21H,1-4H3,(H,26,27,31)/b29-28+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	1.07E+4	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223489 (US9320734, 360) Show SMILES CC1=NN(C(=O)c2ccc(O)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H17N7O5S/c1-13-18(20(31)28(26-13)19(30)14-3-7-16(29)8-4-14)25-24-15-5-9-17(10-6-15)34(32,33)27-21-22-11-2-12-23-21/h2-12,18,29H,1H3,(H,22,23,27)/b25-24+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	1.74E+3	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223489 (US9320734, 360) Show SMILES CC1=NN(C(=O)c2ccc(O)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H17N7O5S/c1-13-18(20(31)28(26-13)19(30)14-3-7-16(29)8-4-14)25-24-15-5-9-17(10-6-15)34(32,33)27-21-22-11-2-12-23-21/h2-12,18,29H,1H3,(H,22,23,27)/b25-24+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	1.07E+4	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223490 (US9320734, 335) Show SMILES CC1=NN(C(O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1)C(=O)c1ccc(Cl)cc1 |t:1| Show InChI InChI=1S/C21H18ClN7O4S/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/h2-12,18,20,31H,1H3,(H,23,24,28)/b26-25+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	520	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (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	n/a	390	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223487 (US9320734, 333) Show SMILES CC1=NN(C(=O)c2ccc(N)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H18N8O4S/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,22H2,1H3,(H,23,24,28)/b26-25+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	140	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (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	n/a	1.99E+3	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair
Insulin receptor substrate 1 [1-264] (Homo sapiens (Human))	BDBM223487 (US9320734, 333) Show SMILES CC1=NN(C(=O)c2ccc(N)cc2)C(=O)C1\N=N\c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |t:1| Show InChI InChI=1S/C21H18N8O4S/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,22H2,1H3,(H,23,24,28)/b26-25+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	1.80E+3	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 KT1 PH domain small molecule inhibitors were identified using the crystal structure of the AKT1 PH domain bound by PtdIns(1,3,4,5)P4 as descried in T...				US Patent US9320734 (2016) BindingDB Entry DOI: 10.7270/Q2QF8RRM
					More data for this Ligand-Target Pair