Compile Data Set for Download or QSAR

Found 74 hits with Last Name = 'mugrage' and Initial = 'b'   

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
Endothelin-1 receptor (Sus scrofa)	BDBM50280989 (2,6-dimethyl-5-methyloxycarbonyl-4-(3-nitrophenyl)...) Show SMILES COC(=O)C1[C@@H](C(C(=O)OC(=[OH+])C2=C(C)N=C(C)C([C@H]2c2cccc(c2)[N+]([O-])=O)=C([O-])OC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |w:29.31,c:12,37,t:15,34| Show InChI InChI=1S/C32H30N4O11/c1-15-23(29(37)45-5)27(19-9-7-11-21(13-19)35(41)42)25(17(3)33-15)31(39)47-32(40)26-18(4)34-16(2)24(30(38)46-6)28(26)20-10-8-12-22(14-20)36(43)44/h7-14,23,27-28,38H,1-6H3/t23?,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for its ability to inhibit the binding of [125I]-ET-1 to the Endothelin A receptor in porcine thoracic aorta membranes.				Bioorg Med Chem Lett 3: 2099-2104 (1993) Article DOI: 10.1016/S0960-894X(01)81025-8 BindingDB Entry DOI: 10.7270/Q2DV1JS8
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM123744 (5-Fluoro-N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo[d]imi...) Show SMILES Fc1ccc2[nH]c(cc2c1)C(=O)NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O Show InChI InChI=1S/C23H24FN5O2/c24-16-5-6-18-15(13-16)14-20(26-18)22(30)25-9-12-28-10-7-17(8-11-28)29-21-4-2-1-3-19(21)27-23(29)31/h1-6,13-14,17,26H,7-12H2,(H,25,30)(H,27,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206156 (CHEMBL246240 | N-(2-(4-(2-oxo-2,3-dihydrobenzo[d]i...) Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1cc2ccccc2[nH]1 Show InChI InChI=1S/C23H25N5O2/c29-22(20-15-16-5-1-2-6-18(16)25-20)24-11-14-27-12-9-17(10-13-27)28-21-8-4-3-7-19(21)26-23(28)30/h1-8,15,17,25H,9-14H2,(H,24,29)(H,26,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50280989 (2,6-dimethyl-5-methyloxycarbonyl-4-(3-nitrophenyl)...) Show SMILES COC(=O)C1[C@@H](C(C(=O)OC(=[OH+])C2=C(C)N=C(C)C([C@H]2c2cccc(c2)[N+]([O-])=O)=C([O-])OC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |w:29.31,c:12,37,t:15,34| Show InChI InChI=1S/C32H30N4O11/c1-15-23(29(37)45-5)27(19-9-7-11-21(13-19)35(41)42)25(17(3)33-15)31(39)47-32(40)26-18(4)34-16(2)24(30(38)46-6)28(26)20-10-8-12-22(14-20)36(43)44/h7-14,23,27-28,38H,1-6H3/t23?,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for its ability to inhibit the binding of [125I]-ET-1 to the Endothelin B receptor in rat cerebellum membranes.				Bioorg Med Chem Lett 3: 2099-2104 (1993) Article DOI: 10.1016/S0960-894X(01)81025-8 BindingDB Entry DOI: 10.7270/Q2DV1JS8
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50280990 (2,6-dimethyl-5-methyloxycarbonyl-4-(3-nitrophenyl)...) Show SMILES COC(=O)C1[C@@H](C(C(=O)OC(=[OH+])C2=C(C)N=C(C)C([C@@H]2c2cccc(c2)[N+]([O-])=O)=C([O-])OC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |w:29.31,c:12,37,t:15,34| Show InChI InChI=1S/C32H30N4O11/c1-15-23(29(37)45-5)27(19-9-7-11-21(13-19)35(41)42)25(17(3)33-15)31(39)47-32(40)26-18(4)34-16(2)24(30(38)46-6)28(26)20-10-8-12-22(14-20)36(43)44/h7-14,23,27-28,38H,1-6H3/t23?,27-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	422	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for its inhibitory activity against Endothelin A receptor				Bioorg Med Chem Lett 3: 2099-2104 (1993) Article DOI: 10.1016/S0960-894X(01)81025-8 BindingDB Entry DOI: 10.7270/Q2DV1JS8
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1S (Rattus norvegicus-RAT)	BDBM50280989 (2,6-dimethyl-5-methyloxycarbonyl-4-(3-nitrophenyl)...) Show SMILES COC(=O)C1[C@@H](C(C(=O)OC(=[OH+])C2=C(C)N=C(C)C([C@H]2c2cccc(c2)[N+]([O-])=O)=C([O-])OC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |w:29.31,c:12,37,t:15,34| Show InChI InChI=1S/C32H30N4O11/c1-15-23(29(37)45-5)27(19-9-7-11-21(13-19)35(41)42)25(17(3)33-15)31(39)47-32(40)26-18(4)34-16(2)24(30(38)46-6)28(26)20-10-8-12-22(14-20)36(43)44/h7-14,23,27-28,38H,1-6H3/t23?,27-,28+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	592	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]PN-200-110 binding to L-type calcium channels in rat cortex membranes.				Bioorg Med Chem Lett 3: 2099-2104 (1993) Article DOI: 10.1016/S0960-894X(01)81025-8 BindingDB Entry DOI: 10.7270/Q2DV1JS8
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206153 (CHEMBL246032 | N-(2-(4-(2-oxo-2,3-dihydro-1H-benzo...) Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1cnc2ccccc2c1 Show InChI InChI=1S/C24H25N5O2/c30-23(18-15-17-5-1-2-6-20(17)26-16-18)25-11-14-28-12-9-19(10-13-28)29-22-8-4-3-7-21(22)27-24(29)31/h1-8,15-16,19H,9-14H2,(H,25,30)(H,27,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206155 (CHEMBL246031 | N-(2-(4-(2-oxo-2,3-dihydrobenzo[d]i...) Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccsc1 Show InChI InChI=1S/C19H22N4O2S/c24-18(14-7-12-26-13-14)20-8-11-22-9-5-15(6-10-22)23-17-4-2-1-3-16(17)21-19(23)25/h1-4,7,12-13,15H,5-6,8-11H2,(H,20,24)(H,21,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206159 (4-fluoro-N-(2-(4-(2-oxo-2,3-dihydrobenzo[d]imidazo...) Show SMILES Fc1ccc(cc1)C(=O)NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O Show InChI InChI=1S/C21H23FN4O2/c22-16-7-5-15(6-8-16)20(27)23-11-14-25-12-9-17(10-13-25)26-19-4-2-1-3-18(19)24-21(26)28/h1-8,17H,9-14H2,(H,23,27)(H,24,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156655 (US9023354, AD4-10315) Show SMILES Oc1c(ccc2cccnc12)C(Nc1cccnc1)c1cccs1 Show InChI InChI=1S/C19H15N3OS/c23-19-15(8-7-13-4-1-10-21-17(13)19)18(16-6-3-11-24-16)22-14-5-2-9-20-12-14/h1-12,18,22-23H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206160 (CHEMBL245621 | Halopemide | Halopemide, 8 | N-(2-(...) Show SMILES Fc1ccc(cc1)C(=O)NCCN1CCC(CC1)n1c2ccc(Cl)cc2[nH]c1=O Show InChI InChI=1S/C21H22ClFN4O2/c22-15-3-6-19-18(13-15)25-21(29)27(19)17-7-10-26(11-8-17)12-9-24-20(28)14-1-4-16(23)5-2-14/h1-6,13,17H,7-12H2,(H,24,28)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase D2 (Homo sapiens (Human))	BDBM50206154 (CHEMBL245623 | N-(2-(4-(2-oxo-2,3-dihydrobenzo[d]i...) Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccccc1 Show InChI InChI=1S/C21H24N4O2/c26-20(16-6-2-1-3-7-16)22-12-15-24-13-10-17(11-14-24)25-19-9-5-4-8-18(19)23-21(25)27/h1-9,17H,10-15H2,(H,22,26)(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
Phospholipase D2 (Homo sapiens (Human))	BDBM50206157 (CHEMBL398568 | N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo...) Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1cc2ccccc2s1 Show InChI InChI=1S/C23H24N4O2S/c28-22(21-15-16-5-1-4-8-20(16)30-21)24-11-14-26-12-9-17(10-13-26)27-19-7-3-2-6-18(19)25-23(27)29/h1-8,15,17H,9-14H2,(H,24,28)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PLD2				Bioorg Med Chem Lett 17: 2310-1 (2007) Article DOI: 10.1016/j.bmcl.2007.01.059 BindingDB Entry DOI: 10.7270/Q21G0KXW
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156660 (US9023354, AD4-10963) Show SMILES Cc1ccsc1C(Nc1cc(C)ccn1)c1ccc2cccnc2c1O Show InChI InChI=1S/C21H19N3OS/c1-13-7-10-22-17(12-13)24-19(21-14(2)8-11-26-21)16-6-5-15-4-3-9-23-18(15)20(16)25/h3-12,19,25H,1-2H3,(H,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50280990 (2,6-dimethyl-5-methyloxycarbonyl-4-(3-nitrophenyl)...) Show SMILES COC(=O)C1[C@@H](C(C(=O)OC(=[OH+])C2=C(C)N=C(C)C([C@@H]2c2cccc(c2)[N+]([O-])=O)=C([O-])OC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |w:29.31,c:12,37,t:15,34| Show InChI InChI=1S/C32H30N4O11/c1-15-23(29(37)45-5)27(19-9-7-11-21(13-19)35(41)42)25(17(3)33-15)31(39)47-32(40)26-18(4)34-16(2)24(30(38)46-6)28(26)20-10-8-12-22(14-20)36(43)44/h7-14,23,27-28,38H,1-6H3/t23?,27-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for its inhibitory activity against Endothelin B receptor				Bioorg Med Chem Lett 3: 2099-2104 (1993) Article DOI: 10.1016/S0960-894X(01)81025-8 BindingDB Entry DOI: 10.7270/Q2DV1JS8
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM50447144 (CHEMBL3112895 | US9023354, AD4-12917) Show SMILES Cc1ccnc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3cccnc3c2O)c1 Show InChI InChI=1S/C22H17Cl2N3O/c1-13-8-10-25-19(11-13)27-20(15-5-7-17(23)18(24)12-15)16-6-4-14-3-2-9-26-21(14)22(16)28/h2-12,20,28H,1H3,(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47305 (BDBM156659 | US9023354, AD4-10483) Show SMILES Cc1cccc(NC(c2ccc(cc2)C(F)(F)F)c2ccc3cccnc3c2O)n1 Show InChI InChI=1S/C23H18F3N3O/c1-14-4-2-6-19(28-14)29-20(16-7-10-17(11-8-16)23(24,25)26)18-12-9-15-5-3-13-27-21(15)22(18)30/h2-13,20,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156422 (US9023354, AD4-12909) Show SMILES COc1ccc(cc1O)C(Nc1cccc(C)n1)c1ccc2cccnc2c1O Show InChI InChI=1S/C23H21N3O3/c1-14-5-3-7-20(25-14)26-21(16-9-11-19(29-2)18(27)13-16)17-10-8-15-6-4-12-24-22(15)23(17)28/h3-13,21,27-28H,1-2H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156414 (US9023354, AD4-1505) Show SMILES COc1ccc(cc1O)C(Nc1cc(C)ccn1)c1ccc2cccnc2c1O Show InChI InChI=1S/C23H21N3O3/c1-14-9-11-24-20(12-14)26-21(16-6-8-19(29-2)18(27)13-16)17-7-5-15-4-3-10-25-22(15)23(17)28/h3-13,21,27-28H,1-2H3,(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156419 (US9023354, AD4-12906) Show SMILES Cc1ccnc(NC(c2cccc(Cl)c2Cl)c2ccc3cccnc3c2O)c1 Show InChI InChI=1S/C22H17Cl2N3O/c1-13-9-11-25-18(12-13)27-21(15-5-2-6-17(23)19(15)24)16-8-7-14-4-3-10-26-20(14)22(16)28/h2-12,21,28H,1H3,(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47305 (BDBM156659 | US9023354, AD4-10483) Show SMILES Cc1cccc(NC(c2ccc(cc2)C(F)(F)F)c2ccc3cccnc3c2O)n1 Show InChI InChI=1S/C23H18F3N3O/c1-14-4-2-6-19(28-14)29-20(16-7-10-17(11-8-16)23(24,25)26)18-12-9-15-5-3-13-27-21(15)22(18)30/h2-13,20,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156430 (US9023354, AD4-12918) Show SMILES Cc1cccc(NC(c2ccc3cccnc3c2O)c2c(F)c(F)cc(F)c2F)n1 Show InChI InChI=1S/C22H15F4N3O/c1-11-4-2-6-16(28-11)29-21(17-18(25)14(23)10-15(24)19(17)26)13-8-7-12-5-3-9-27-20(12)22(13)30/h2-10,21,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156506 (US9023354, AD4-13080) Show SMILES Cc1cccc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3ccc(C)nc3c2O)n1 Show InChI InChI=1S/C23H19Cl2N3O/c1-13-4-3-5-20(26-13)28-21(16-9-11-18(24)19(25)12-16)17-10-8-15-7-6-14(2)27-22(15)23(17)29/h3-12,21,29H,1-2H3,(H,26,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156654 (US9023354, AD4-10484) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H15Cl2N3O/c22-14-7-9-15(17(23)12-14)20(26-18-5-1-2-10-24-18)16-8-6-13-4-3-11-25-19(13)21(16)27/h1-12,20,27H,(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156423 (US9023354, AD4-12910) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1cc(Cl)ccc1Cl Show InChI InChI=1S/C21H15Cl2N3O/c22-14-7-9-17(23)16(12-14)20(26-18-5-1-2-10-24-18)15-8-6-13-4-3-11-25-19(13)21(15)27/h1-12,20,27H,(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156492 (US9023354, AD4-13067) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(Cl)c(c1)C(F)(F)F Show InChI InChI=1S/C22H14Cl2F3N3O/c23-14-5-8-18(29-11-14)30-19(13-4-7-17(24)16(10-13)22(25,26)27)15-6-3-12-2-1-9-28-20(12)21(15)31/h1-11,19,31H,(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156495 (US9023354, AD4-13070) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1c(F)c(F)cc(F)c1F Show InChI InChI=1S/C21H12F5N3O/c22-11-4-6-15(28-9-11)29-20(16-17(25)13(23)8-14(24)18(16)26)12-5-3-10-2-1-7-27-19(10)21(12)30/h1-9,20,30H,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47310 (US9023354, AD4-13243) Show SMILES Cc1cc(Cl)cnc1NC(c1ccc2cccnc2c1O)c1c(F)c(F)c(OCC(F)(F)F)c(F)c1F Show InChI InChI=1S/C24H15ClF7N3O2/c1-10-7-12(25)8-34-23(10)35-20(13-5-4-11-3-2-6-33-19(11)21(13)36)14-15(26)17(28)22(18(29)16(14)27)37-9-24(30,31)32/h2-8,20,36H,9H2,1H3,(H,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156479 (US9023354, AD4-13054) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C21H14Cl3N3O/c22-14-5-8-18(26-11-14)27-19(13-4-7-16(23)17(24)10-13)15-6-3-12-2-1-9-25-20(12)21(15)28/h1-11,19,28H,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156540 (US9023354, AD4-13113) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C21H14Cl2FN3O/c22-16-7-4-13(10-17(16)23)19(27-18-8-5-14(24)11-26-18)15-6-3-12-2-1-9-25-20(12)21(15)28/h1-11,19,28H,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156420 (US9023354, AD4-12907) Show SMILES Cc1ccnc(NC(c2ccccc2Cl)c2ccc3cccnc3c2O)c1 Show InChI InChI=1S/C22H18ClN3O/c1-14-10-12-24-19(13-14)26-21(16-6-2-3-7-18(16)23)17-9-8-15-5-4-11-25-20(15)22(17)27/h2-13,21,27H,1H3,(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156415 (US9023354, AD4-12902) Show SMILES Cc1cccc(NC(c2ccc(OC(F)(F)F)cc2)c2ccc3cccnc3c2O)n1 Show InChI InChI=1S/C23H18F3N3O2/c1-14-4-2-6-19(28-14)29-20(16-7-10-17(11-8-16)31-23(24,25)26)18-12-9-15-5-3-13-27-21(15)22(18)30/h2-13,20,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.40E+3	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156626 (US9023354, AD4-13202) Show SMILES Cc1nc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3cccnc3c2O)c(Cl)cc1Cl Show InChI InChI=1S/C22H15Cl4N3O/c1-11-16(24)10-18(26)22(28-11)29-19(13-5-7-15(23)17(25)9-13)14-6-4-12-3-2-8-27-20(12)21(14)30/h2-10,19,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156527 (US9023354, AD4-13099) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1ccc(F)cc1Cl Show InChI InChI=1S/C21H14ClF2N3O/c22-17-10-13(23)4-7-15(17)20(27-18-8-5-14(24)11-26-18)16-6-3-12-2-1-9-25-19(12)21(16)28/h1-11,20,28H,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156620 (US9023354, AD4-13196) Show SMILES COc1ccc(C(Nc2cc(C)c(Cl)cn2)c2ccc3cccnc3c2O)c(OC)c1OC Show InChI InChI=1S/C25H24ClN3O4/c1-14-12-20(28-13-18(14)26)29-22(16-8-7-15-6-5-11-27-21(15)23(16)30)17-9-10-19(31-2)25(33-4)24(17)32-3/h5-13,22,30H,1-4H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156478 (US9023354, AD4-13053) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C22H15ClF3N3O/c23-16-8-10-18(28-12-16)29-19(14-3-6-15(7-4-14)22(24,25)26)17-9-5-13-2-1-11-27-20(13)21(17)30/h1-12,19,30H,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156543 (US9023354, AD4-13116) Show SMILES Cc1cc(NC(c2ccccc2Cl)c2ccc3cccnc3c2O)ncc1F Show InChI InChI=1S/C22H17ClFN3O/c1-13-11-19(26-12-18(13)24)27-21(15-6-2-3-7-17(15)23)16-9-8-14-5-4-10-25-20(14)22(16)28/h2-12,21,28H,1H3,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156632 (US9023354, AD4-13208) Show SMILES COc1ccc(C(Nc2ncc(Cl)cc2C)c2ccc3cccnc3c2O)c(OC)c1OC Show InChI InChI=1S/C25H24ClN3O4/c1-14-12-16(26)13-28-25(14)29-21(17-8-7-15-6-5-11-27-20(15)22(17)30)18-9-10-19(31-2)24(33-4)23(18)32-3/h5-13,21,30H,1-4H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156418 (US9023354, AD4-12905) Show SMILES Cc1cccc(NC(c2cccc(Cl)c2Cl)c2ccc3cccnc3c2O)n1 Show InChI InChI=1S/C22H17Cl2N3O/c1-13-5-2-9-18(26-13)27-21(15-7-3-8-17(23)19(15)24)16-11-10-14-6-4-12-25-20(14)22(16)28/h2-12,21,28H,1H3,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156517 (US9023354, AD4-13089) Show SMILES Cc1cccc(NC(c2ccc3ccc(C)nc3c2O)c2c(Cl)cccc2Cl)n1 Show InChI InChI=1S/C23H19Cl2N3O/c1-13-5-3-8-19(26-13)28-22(20-17(24)6-4-7-18(20)25)16-12-11-15-10-9-14(2)27-21(15)23(16)29/h3-12,22,29H,1-2H3,(H,26,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47298 (BDBM64616 | US9023354, AD4-10960) Show SMILES CCC(=O)NC(c1cccs1)c1cc([N+]([O-])=O)c2cccnc2c1O Show InChI InChI=1S/C17H15N3O4S/c1-2-14(21)19-15(13-6-4-8-25-13)11-9-12(20(23)24)10-5-3-7-18-16(10)17(11)22/h3-9,15,22H,2H2,1H3,(H,19,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47300 (US9023354, AD4-10944) Show SMILES Cc1ccc(C)c(c1)C(Nc1cccnc1)c1cc(Cl)c2cccnc2c1O Show InChI InChI=1S/C23H20ClN3O/c1-14-7-8-15(2)18(11-14)21(27-16-5-3-9-25-13-16)19-12-20(24)17-6-4-10-26-22(17)23(19)28/h3-13,21,27-28H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156416 (US9023354, AD4-12903) Show SMILES Cc1cccc(NC(c2cccc(c2)C(F)(F)F)c2ccc3cccnc3c2O)n1 Show InChI InChI=1S/C23H18F3N3O/c1-14-5-2-9-19(28-14)29-20(16-6-3-8-17(13-16)23(24,25)26)18-11-10-15-7-4-12-27-21(15)22(18)30/h2-13,20,30H,1H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47307 (BDBM50339143 | US9023354, AD4-10942) Show SMILES Oc1c(ccc2cccnc12)C(Nc1cccnc1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C22H16F3N3O/c23-22(24,25)16-8-5-15(6-9-16)19(28-17-4-2-11-26-13-17)18-10-7-14-3-1-12-27-20(14)21(18)29/h1-13,19,28-29H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM47303 (US9023354, AD4-10482) Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1ccccc1Cl Show InChI InChI=1S/C21H16ClN3O/c22-17-8-2-1-7-15(17)20(25-18-9-3-4-12-23-18)16-11-10-14-6-5-13-24-19(14)21(16)26/h1-13,20,26H,(H,23,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156621 (US9023354, AD4-13197) Show SMILES COc1ccc(C(Nc2cc(Cl)c(Cl)cn2)c2ccc3cccnc3c2O)c(OC)c1OC Show InChI InChI=1S/C24H21Cl2N3O4/c1-31-18-9-8-15(23(32-2)24(18)33-3)21(29-19-11-16(25)17(26)12-28-19)14-7-6-13-5-4-10-27-20(13)22(14)30/h4-12,21,30H,1-3H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156635 (US9023354, AD4-13210) Show SMILES COc1ccc(C(Nc2nc(C)c(Cl)cc2Cl)c2ccc3cccnc3c2O)c(OC)c1OC Show InChI InChI=1S/C25H23Cl2N3O4/c1-13-17(26)12-18(27)25(29-13)30-21(15-8-7-14-6-5-11-28-20(14)22(15)31)16-9-10-19(32-2)24(34-4)23(16)33-3/h5-12,21,31H,1-4H3,(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156528 (US9023354, AD4-13101) Show SMILES Cc1ccc2ccc(C(Nc3cccnc3)c3c(F)c(F)c(OCC(F)(F)F)c(F)c3F)c(O)c2n1 Show InChI InChI=1S/C24H16F7N3O2/c1-11-4-5-12-6-7-14(22(35)20(12)33-11)21(34-13-3-2-8-32-9-13)15-16(25)18(27)23(19(28)17(15)26)36-10-24(29,30)31/h2-9,21,34-35H,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156639 (US9023354, AD4-13214) Show SMILES COc1ccc(C(Nc2ncc(Cl)cc2OC)c2ccc3cccnc3c2O)c(OC)c1OC Show InChI InChI=1S/C25H24ClN3O5/c1-31-18-10-9-17(23(33-3)24(18)34-4)21(29-25-19(32-2)12-15(26)13-28-25)16-8-7-14-6-5-11-27-20(14)22(16)30/h5-13,21,30H,1-4H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM156617 (US9023354, AD4-13193) Show SMILES COc1ccc(cc1OC)C(Nc1ncc(Cl)cc1C)c1ccc2cccnc2c1O Show InChI InChI=1S/C24H22ClN3O3/c1-14-11-17(25)13-27-24(14)28-21(16-7-9-19(30-2)20(12-16)31-3)18-8-6-15-5-4-10-26-22(15)23(18)29/h4-13,21,29H,1-3H3,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	25
TBA US Patent					Assay Description The following example describes an assay that measured the ability of compounds to inhibit the binding of p53 to MDM2 using the AlphaScreen assay tec...				US Patent US9023354 (2015) BindingDB Entry DOI: 10.7270/Q26M35KH
					More data for this Ligand-Target Pair

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