Compile Data Set for Download or QSAR

Found 701 hits of ic50 data for polymerid = 6958   

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
Menin (Homo sapiens (Human))	BDBM50454121 (CHEMBL4211366) Show SMILES [H][C@@]12CN(CC(O)CCCc3ccccc3)C[C@@]([H])(C1)n1c(C2)cccc1=O |THB:26:20:2.3.16:19,4:3:19:20.21.22| Show InChI InChI=1S/C22H28N2O2/c25-21(10-4-8-17-6-2-1-3-7-17)16-23-14-18-12-19-9-5-11-22(26)24(19)20(13-18)15-23/h1-3,5-7,9,11,18,20-21,25H,4,8,10,12-16H2/t18-,20+,21?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Displacement of FITC-MBM1 from menin (unknown origin) measured after 1 hr by fluorescence polarization assay				Bioorg Med Chem 26: 356-365 (2018) Article DOI: 10.1016/j.bmc.2017.11.045 BindingDB Entry DOI: 10.7270/Q2SQ92ZS
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511905 (CHEMBL4530300) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CC(F)(F)C2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C43H57F3N6O5S/c1-57-41(54)47-39-9-3-8-38(39)43(30-49-18-5-19-49,33-6-2-7-34(44)22-33)32-15-20-48(21-16-32)23-31-24-51(25-31)35-11-13-36(14-12-35)58(55,56)37-26-52(27-37)40(53)10-4-17-50-28-42(45,46)29-50/h2,4,6-7,10-14,22,31-32,37-39H,3,5,8-9,15-21,23-30H2,1H3,(H,47,54)/b10-4+/t38-,39-,43-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506357 (US11045448, Cpd. No. 66 | methyl ((1S,2R)-2-((S)-1...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2(F)CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582737 (CHEMBL5076146) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN(C)C)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511899 (CHEMBL4457657 | US11045448, Cpd. No. 67) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](Cn1ccnc1CC)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C44H60FN7O5S/c1-5-41-46-20-24-50(41)31-44(34-9-6-10-35(45)25-34,39-11-7-12-40(39)47-43(54)57-4)33-18-22-49(23-19-33)26-32-27-51(28-32)36-14-16-37(17-15-36)58(55,56)38-29-52(30-38)42(53)13-8-21-48(2)3/h6,8-10,13-17,20,24-25,32-33,38-40H,5,7,11-12,18-19,21-23,26-31H2,1-4H3,(H,47,54)/b13-8+/t39-,40-,44-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511898 (CHEMBL4456868) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CC(F)C2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C43H58F2N6O5S/c1-56-42(53)46-40-9-3-8-39(40)43(30-48-18-5-19-48,33-6-2-7-34(44)22-33)32-15-20-47(21-16-32)23-31-24-50(25-31)36-11-13-37(14-12-36)57(54,55)38-28-51(29-38)41(52)10-4-17-49-26-35(45)27-49/h2,4,6-7,10-14,22,31-32,35,38-40H,3,5,8-9,15-21,23-30H2,1H3,(H,46,53)/b10-4+/t39-,40-,43-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511900 (CHEMBL4454017 | US11045448, Cpd. No. 72) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](Cn1ccnn1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C41H55FN8O5S/c1-46(2)19-6-11-39(51)49-27-36(28-49)56(53,54)35-14-12-34(13-15-35)48-25-30(26-48)24-47-20-16-31(17-21-47)41(29-50-22-18-43-45-50,32-7-4-8-33(42)23-32)37-9-5-10-38(37)44-40(52)55-3/h4,6-8,11-15,18,22-23,30-31,36-38H,5,9-10,16-17,19-21,24-29H2,1-3H3,(H,44,52)/b11-6+/t37-,38-,41-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506364 (US11045448, Cpd. No. 73 | methyl ((1S,2R)-2-((S)-2...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCCCC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511900 (CHEMBL4454017 | US11045448, Cpd. No. 72) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](Cn1ccnn1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C41H55FN8O5S/c1-46(2)19-6-11-39(51)49-27-36(28-49)56(53,54)35-14-12-34(13-15-35)48-25-30(26-48)24-47-20-16-31(17-21-47)41(29-50-22-18-43-45-50,32-7-4-8-33(42)23-32)37-9-5-10-38(37)44-40(52)55-3/h4,6-8,11-15,18,22-23,30-31,36-38H,5,9-10,16-17,19-21,24-29H2,1-3H3,(H,44,52)/b11-6+/t37-,38-,41-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511899 (CHEMBL4457657 | US11045448, Cpd. No. 67) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](Cn1ccnc1CC)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C44H60FN7O5S/c1-5-41-46-20-24-50(41)31-44(34-9-6-10-35(45)25-34,39-11-7-12-40(39)47-43(54)57-4)33-18-22-49(23-19-33)26-32-27-51(28-32)36-14-16-37(17-15-36)58(55,56)38-29-52(30-38)42(53)13-8-21-48(2)3/h6,8-10,13-17,20,24-25,32-33,38-40H,5,7,11-12,18-19,21-23,26-31H2,1-4H3,(H,47,54)/b13-8+/t39-,40-,44-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506354 (US11045448, Cpd. No. 63 | methyl ((1S,2R)-2-((S)-c...) Show SMILES COC(=O)N[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)\C=C\CN(C)C)c2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506346 (US11045448, Cpd. No. 16 | methyl ((1S,2R)-2-((S)-1...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2(F)CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)C=C)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506342 ((1S,2R)-2-((S)-(1-((1-(4-((4- acrylamidophenyl)sul...) Show SMILES CNC(=O)O[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2ccc(NC(=O)C=C)cc2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511901 (CHEMBL4528467) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C43H61FN6O5S/c1-46(2)20-8-13-41(51)50-29-38(30-50)56(53,54)37-16-14-36(15-17-37)49-27-32(28-49)26-47-23-18-33(19-24-47)43(31-48-21-4-5-22-48,34-9-6-10-35(44)25-34)39-11-7-12-40(39)45-42(52)55-3/h6,8-10,13-17,25,32-33,38-40H,4-5,7,11-12,18-24,26-31H2,1-3H3,(H,45,52)/b13-8+/t39-,40-,43-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511902 (CHEMBL4553102) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)C=C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C39H52FN5O5S/c1-3-37(46)45-25-34(26-45)51(48,49)33-13-11-32(12-14-33)44-23-28(24-44)22-42-19-15-29(16-20-42)39(27-43-17-6-18-43,30-7-4-8-31(40)21-30)35-9-5-10-36(35)41-38(47)50-2/h3-4,7-8,11-14,21,28-29,34-36H,1,5-6,9-10,15-20,22-27H2,2H3,(H,41,47)/t35-,36-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511903 (CHEMBL4588924) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCC2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C43H59FN6O5S/c1-55-42(52)45-40-10-3-9-39(40)43(31-48-21-6-22-48,34-7-2-8-35(44)25-34)33-16-23-47(24-17-33)26-32-27-49(28-32)36-12-14-37(15-13-36)56(53,54)38-29-50(30-38)41(51)11-4-18-46-19-5-20-46/h2,4,7-8,11-15,25,32-33,38-40H,3,5-6,9-10,16-24,26-31H2,1H3,(H,45,52)/b11-4+/t39-,40-,43-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511908 (CHEMBL4456003) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCCC2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C44H61FN6O5S/c1-56-43(53)46-41-11-5-10-40(41)44(32-49-22-7-23-49,35-8-4-9-36(45)26-35)34-17-24-48(25-18-34)27-33-28-50(29-33)37-13-15-38(16-14-37)57(54,55)39-30-51(31-39)42(52)12-6-21-47-19-2-3-20-47/h4,6,8-9,12-16,26,33-34,39-41H,2-3,5,7,10-11,17-25,27-32H2,1H3,(H,46,53)/b12-6+/t40-,41-,44-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511910 (CHEMBL4450979) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCC(F)(F)CC2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C45H61F3N6O5S/c1-59-43(56)49-41-9-3-8-40(41)45(32-52-20-5-21-52,35-6-2-7-36(46)26-35)34-15-22-51(23-16-34)27-33-28-53(29-33)37-11-13-38(14-12-37)60(57,58)39-30-54(31-39)42(55)10-4-19-50-24-17-44(47,48)18-25-50/h2,4,6-7,10-14,26,33-34,39-41H,3,5,8-9,15-25,27-32H2,1H3,(H,49,56)/b10-4+/t40-,41-,45-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511912 (CHEMBL4571451) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCCCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C44H63FN6O5S/c1-47(2)21-9-14-42(52)51-30-39(31-51)57(54,55)38-17-15-37(16-18-38)50-28-33(29-50)27-48-24-19-34(20-25-48)44(32-49-22-5-4-6-23-49,35-10-7-11-36(45)26-35)40-12-8-13-41(40)46-43(53)56-3/h7,9-11,14-18,26,33-34,39-41H,4-6,8,12-13,19-25,27-32H2,1-3H3,(H,46,53)/b14-9+/t40-,41-,44-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506337 (US11045448, Cpd. No. 5 | methyl ((1S,2R)-2-((S)-(1...) Show SMILES COC(=O)N[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)C=C)c2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506340 (US11045448, Cpd. No. 8 | methyl ((1S,2R)-2-((S)-1-...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)C=C)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506341 (US11045448, Cpd. No. 9 | methyl ((1S,2R)-2-((S)-1-...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2(F)CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)C=C)c2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582744 (CHEMBL5085940) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)OC)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511904 (CHEMBL4438797) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCCCC2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C45H63FN6O5S/c1-57-44(54)47-42-12-6-11-41(42)45(33-50-23-8-24-50,36-9-5-10-37(46)27-36)35-18-25-49(26-19-35)28-34-29-51(30-34)38-14-16-39(17-15-38)58(55,56)40-31-52(32-40)43(53)13-7-22-48-20-3-2-4-21-48/h5,7,9-10,13-17,27,34-35,40-42H,2-4,6,8,11-12,18-26,28-33H2,1H3,(H,47,54)/b13-7+/t41-,42-,45-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582746 (CHEMBL5081367) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)OC)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582751 (CHEMBL5094183) Show SMILES [H][C@]12CN([C@]([H])(CN1C(=O)C=C)C2)S(=O)(=O)c1ccc(cc1)N1CC(CN2CCC(CC2)[C@@](CN2CCC2)(c2cccc(F)c2)[C@@]2([H])CCC[C@@H]2NC(=O)OC)(C1)OC |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582747 (CHEMBL5079678) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)C=C)OC)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582738 (CHEMBL5071412) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582735 (CHEMBL5090509) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(C)CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480146 (US10899738, Cpd. No 206 | rac-(1S,2R)-2-(2-methyl-...) Show SMILES CN1Cc2ccccc2C(C1)([C@H]1CCC[C@@H]1OC(C)=O)C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2ccncc2)CC1 |r| Show InChI InChI=1S/C37H46N4O4S/c1-27(42)45-36-9-5-8-35(36)37(26-39(2)25-29-6-3-4-7-34(29)37)30-16-20-40(21-17-30)22-28-23-41(24-28)31-10-12-32(13-11-31)46(43,44)33-14-18-38-19-15-33/h3-4,6-7,10-15,18-19,28,30,35-36H,5,8-9,16-17,20-26H2,1-2H3/t35-,36-,37?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480158 (US10899738, Cpd. No 219 | rac-(1S,2R)-2-(2-methyl-...) Show SMILES CN1Cc2ccccc2C(C1)([C@H]1CCC[C@@H]1OC(N)=O)C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2ccncc2)CC1 |r| Show InChI InChI=1S/C36H45N5O4S/c1-39-24-27-5-2-3-6-32(27)36(25-39,33-7-4-8-34(33)45-35(37)42)28-15-19-40(20-16-28)21-26-22-41(23-26)29-9-11-30(12-10-29)46(43,44)31-13-17-38-18-14-31/h2-3,5-6,9-14,17-18,26,28,33-34H,4,7-8,15-16,19-25H2,1H3,(H2,37,42)/t33-,34-,36?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582749 (CHEMBL5079839) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(CN(C2)c2ccc(cc2)S(=O)(=O)[C@H]2CCCN(C2)C(=O)C=C)OC)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506365 (US11045448, Cpd. No. 74 | methyl ((1S,2R)-2-((S)-c...) Show SMILES COC(=O)N[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN2CCCC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511906 (CHEMBL4435830 | US11045448, Cpd. No. 57) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C39H51FN6O5S/c1-43(2)18-6-11-37(47)46-25-34(26-46)52(49,50)33-14-12-32(13-15-33)45-23-28(24-45)22-44-19-16-29(17-20-44)39(27-41,30-7-4-8-31(40)21-30)35-9-5-10-36(35)42-38(48)51-3/h4,6-8,11-15,21,28-29,34-36H,5,9-10,16-20,22-26H2,1-3H3,(H,42,48)/b11-6+/t35-,36-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506339 (US11045448, Cpd. No. 7 | methyl ((1S,2R)-2-((S)-1-...) Show SMILES CCc1nccn1C[C@]([C@H]1CCC[C@@H]1NC(=O)OC)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)C=C)c2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506338 (US11045448, Cpd. No. 6 | methyl ((1S,2R)-2-((S)-(1...) Show SMILES COC(=O)N[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)C=C)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM506335 ((1S,2R)-2-((S)-(1-((1-(4-((3- acrylamidophenyl)sul...) Show SMILES CNC(=O)O[C@H]1CCC[C@@H]1[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cccc(NC(=O)C=C)c2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				Citation and Details BindingDB Entry DOI: 10.7270/Q2N58QHP
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480346 (US10899738, Cpd. No 411 | rac-(1S,2R)-2-(1-(3- flu...) Show SMILES CNC(=O)O[C@H]1CCC[C@@H]1C(Cn1ccnc1C)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)c2cnn(C)c2)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C38H48FN7O4S/c1-27-41-16-19-45(27)26-38(30-6-4-7-31(39)20-30,35-8-5-9-36(35)50-37(47)40-2)29-14-17-44(18-15-29)22-28-23-46(24-28)32-10-12-33(13-11-32)51(48,49)34-21-42-43(3)25-34/h4,6-7,10-13,16,19-21,25,28-29,35-36H,5,8-9,14-15,17-18,22-24,26H2,1-3H3,(H,40,47)/t35-,36-,38?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480343 (US10899738, Cpd. No 408 | rac-(1S,2R)-2-(1-(1-((1-...) Show SMILES CCc1nccn1CC([C@H]1CCC[C@@H]1OC(=O)NC)(C1CCN(CC2CN(C2)c2ccc(cc2)C#N)CC1)c1ccccc1 |r| Show InChI InChI=1S/C36H46N6O2/c1-3-34-39-18-21-41(34)26-36(29-8-5-4-6-9-29,32-10-7-11-33(32)44-35(43)38-2)30-16-19-40(20-17-30)23-28-24-42(25-28)31-14-12-27(22-37)13-15-31/h4-6,8-9,12-15,18,21,28,30,32-33H,3,7,10-11,16-17,19-20,23-26H2,1-2H3,(H,38,43)/t32-,33-,36?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511906 (CHEMBL4435830 | US11045448, Cpd. No. 57) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C39H51FN6O5S/c1-43(2)18-6-11-37(47)46-25-34(26-46)52(49,50)33-14-12-32(13-15-33)45-23-28(24-45)22-44-19-16-29(17-20-44)39(27-41,30-7-4-8-31(40)21-30)35-9-5-10-36(35)42-38(48)51-3/h4,6-8,11-15,21,28-29,34-36H,5,9-10,16-20,22-26H2,1-3H3,(H,42,48)/b11-6+/t35-,36-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent probe binding to Menin (2 to 610 residues containing deletion from 460-519) (unknown origin) after 60 mins by fluorescence ...				J Med Chem 62: 6015-6034 (2019) Article DOI: 10.1021/acs.jmedchem.9b00021 BindingDB Entry DOI: 10.7270/Q2P84G8G
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511911 (CHEMBL4466396) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C42H59FN6O5S/c1-45(2)19-6-12-40(50)49-28-37(29-49)55(52,53)36-15-13-35(14-16-36)48-26-31(27-48)25-46-22-17-32(18-23-46)42(30-47-20-7-21-47,33-8-4-9-34(43)24-33)38-10-5-11-39(38)44-41(51)54-3/h4,6,8-9,12-16,24,31-32,37-39H,5,7,10-11,17-23,25-30H2,1-3H3,(H,44,51)/b12-6+/t38-,39-,42-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fluorescent labeled tracer binding to Menin (unknown origin) after 1 hr by fluorescence polarization competitive binding assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM470578 (US10815241, Example 3 | US11369605, Example 3) Show SMILES CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CN(C2)C(=O)[C@H]2N[C@H]3CC[C@@H]2C[C@@H]3CC2CC2)C1 Show InChI InChI=1S/C34H45FN6O3/c1-20(2)41(21(3)4)32(42)26-13-25(35)8-10-28(26)44-29-14-36-19-37-31(29)39-15-34(16-39)17-40(18-34)33(43)30-23-7-9-27(38-30)24(12-23)11-22-5-6-22/h8,10,13-14,19-24,27,30,38H,5-7,9,11-12,15-18H2,1-4H3/t23-,24+,27+,30+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. US Patent					Assay Description Menin1-615 wherein 6×His tag and HA tag are inserted in the N-terminus, and myc tag is inserted in the C-terminus (hereinafter, referred to as His-Me...				US Patent US10815241 (2020) BindingDB Entry DOI: 10.7270/Q2C82DCF
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM470581 (5-Fluoro-2-[(4-{7-[(1S,3S,4R)-5-methylidene-2-azab...) Show SMILES CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(C1)CCN(CC2)C(=O)[C@H]1N[C@H]2CC[C@@H]1C(=C)C2 |r,TLB:32:34:37.38:42.40,41:40:34.35:37.38| Show InChI InChI=1S/C33H43FN6O3/c1-20(2)40(21(3)4)31(41)26-15-23(34)6-9-27(26)43-28-16-35-19-36-30(28)39-17-33(18-39)10-12-38(13-11-33)32(42)29-25-8-7-24(37-29)14-22(25)5/h6,9,15-16,19-21,24-25,29,37H,5,7-8,10-14,17-18H2,1-4H3/t24-,25+,29-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. US Patent					Assay Description Menin1-615 wherein 6×His tag and HA tag are inserted in the N-terminus, and myc tag is inserted in the C-terminus (hereinafter, referred to as His-Me...				US Patent US10815241 (2020) BindingDB Entry DOI: 10.7270/Q2C82DCF
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM470582 (US10815241, Example 7 | US11369605, Example 7) Show SMILES CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CN(C2)C(=O)[C@H]2N[C@H]3CC[C@@H]2C(=C)C3)C1 Show InChI InChI=1S/C31H39FN6O3/c1-18(2)38(19(3)4)29(39)24-11-21(32)6-9-25(24)41-26-12-33-17-34-28(26)36-13-31(14-36)15-37(16-31)30(40)27-23-8-7-22(35-27)10-20(23)5/h6,9,11-12,17-19,22-23,27,35H,5,7-8,10,13-16H2,1-4H3/t22-,23+,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. US Patent					Assay Description Menin1-615 wherein 6×His tag and HA tag are inserted in the N-terminus, and myc tag is inserted in the C-terminus (hereinafter, referred to as His-Me...				US Patent US10815241 (2020) BindingDB Entry DOI: 10.7270/Q2C82DCF
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM470585 (US10815241, Example 10 | US11369605, Example 10) Show SMILES CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CN(C2)C(=O)[C@H]2N[C@H]3CC[C@@H]2[C@@H](F)C3)C1 Show InChI InChI=1S/C30H38F2N6O3/c1-17(2)38(18(3)4)28(39)22-9-19(31)5-8-24(22)41-25-11-33-16-34-27(25)36-12-30(13-36)14-37(15-30)29(40)26-21-7-6-20(35-26)10-23(21)32/h5,8-9,11,16-18,20-21,23,26,35H,6-7,10,12-15H2,1-4H3/t20-,21+,23-,26-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. US Patent					Assay Description Menin1-615 wherein 6×His tag and HA tag are inserted in the N-terminus, and myc tag is inserted in the C-terminus (hereinafter, referred to as His-Me...				US Patent US10815241 (2020) BindingDB Entry DOI: 10.7270/Q2C82DCF
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480255 (US10899738, Cpd. No 316 | rac-(1S,2R)-2-(4-(1-((1-...) Show SMILES CN1Cc2ccc(F)cc2C(C1)([C@H]1CCC[C@@H]1OC(C)=O)C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1 |r| Show InChI InChI=1S/C35H46FN3O4S/c1-24(40)43-34-5-3-4-32(34)35(23-37(2)22-26-6-7-28(36)18-33(26)35)27-14-16-38(17-15-27)19-25-20-39(21-25)29-8-10-30(11-9-29)44(41,42)31-12-13-31/h6-11,18,25,27,31-32,34H,3-5,12-17,19-23H2,1-2H3/t32-,34-,35?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM480341 (US10899738, Cpd. No 406 | rac-(1S,2R)-2-(1-(1-((1-...) Show SMILES CNC(=O)O[C@H]1CCC[C@@H]1C(Cn1ccnc1C)(C1CCN(CC2CN(C2)c2ccc(cc2)C#N)CC1)c1ccccc1 |r| Show InChI InChI=1S/C35H44N6O2/c1-26-38-17-20-40(26)25-35(29-7-4-3-5-8-29,32-9-6-10-33(32)43-34(42)37-2)30-15-18-39(19-16-30)22-28-23-41(24-28)31-13-11-27(21-36)12-14-31/h3-5,7-8,11-14,17,20,28,30,32-33H,6,9-10,15-16,18-19,22-25H2,1-2H3,(H,37,42)/t32-,33-,35?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF MICHIGAN US Patent					Assay Description A fluorescence polarization (FP) competitive binding assay was used to determine the binding affinities of representative menin inhibitors. A FAM lab...				US Patent US10899738 (2021) BindingDB Entry DOI: 10.7270/Q28K7D5T
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582734 (CHEMBL5088651) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCC1)(C1CCN(CC2(F)CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50511906 (CHEMBL4435830 | US11045448, Cpd. No. 57) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](C#N)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CN(C2)C(=O)\C=C\CN(C)C)CC1)c1cccc(F)c1 |r| Show InChI InChI=1S/C39H51FN6O5S/c1-43(2)18-6-11-37(47)46-25-34(26-46)52(49,50)33-14-12-32(13-15-33)45-23-28(24-45)22-44-19-16-29(17-20-44)39(27-41,30-7-4-8-31(40)21-30)35-9-5-10-36(35)42-38(48)51-3/h4,6-8,11-15,21,28-29,34-36H,5,9-10,16-20,22-26H2,1-3H3,(H,42,48)/b11-6+/t35-,36-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of menin (unknown origin) by fluorescence polarization assay				J Med Chem 63: 4997-5010 (2020) Article DOI: 10.1021/acs.jmedchem.0c00547 BindingDB Entry DOI: 10.7270/Q2QR51G9
					More data for this Ligand-Target Pair
Menin (Homo sapiens (Human))	BDBM50582740 (CHEMBL5088354) Show SMILES [H][C@@]1(CCC[C@@H]1NC(=O)OC)[C@@](CN1CCOCC1)(C1CCN(CC2CN(C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1)c1cccc(F)c1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to menin (unknown origin) incubated for 1 hr by fluorescence polarization-based competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00789 BindingDB Entry DOI: 10.7270/Q2GX4GFD
					More data for this Ligand-Target Pair

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