Found 192 hits Enz. Inhib. hit(s) with Target = 'Histone-lysine N-methyltransferase 2A' 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 |
|---|
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200712
(US9233086, 10A)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C35H51N7O4/c1-5-34(6-2,41-29(43)24(3)4)31(45)39-27(20-15-23-38-33(36)37)30(44)42-35(21-13-14-22-35)32(46)40-28(25-16-9-7-10-17-25)26-18-11-8-12-19-26/h7-12,16-19,24,27-28H,5-6,13-15,20-23H2,1-4H3,(H,39,45)(H,40,46)(H,41,43)(H,42,44)(H4,36,37,38)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| <1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200722
(US9233086, 10K)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C35H49Cl2N7O4/c1-5-34(6-2,43-29(45)22(3)4)31(47)41-27(10-9-21-40-33(38)39)30(46)44-35(19-7-8-20-35)32(48)42-28(23-11-15-25(36)16-12-23)24-13-17-26(37)18-14-24/h11-18,22,27-28H,5-10,19-21H2,1-4H3,(H,41,47)(H,42,48)(H,43,45)(H,44,46)(H4,38,39,40)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| <1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200723
(US9233086, 10L)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H49F2N7O4/c1-5-34(6-2,43-29(45)22(3)4)31(47)41-27(10-9-21-40-33(38)39)30(46)44-35(19-7-8-20-35)32(48)42-28(23-11-15-25(36)16-12-23)24-13-17-26(37)18-14-24/h11-18,22,27-28H,5-10,19-21H2,1-4H3,(H,41,47)(H,42,48)(H,43,45)(H,44,46)(H4,38,39,40)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| <1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5277647
Show SMILES CCN(CC)c1ccc2oc(=O)c(cc2c1)C(=O)NCc1cn(CCCP(F)(=O)OC)nn1 Show InChI InChI=1S/C21H27FN5O5P/c1-4-26(5-2)17-7-8-19-15(11-17)12-18(21(29)32-19)20(28)23-13-16-14-27(25-24-16)9-6-10-33(22,30)31-3/h7-8,11-12,14H,4-6,9-10,13H2,1-3H3,(H,23,28) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5274392
Show SMILES COP(F)(=O)CCCCn1cc(CNS(=O)(=O)c2ccc(cc2)\N=N\c2ccc(cc2)N(C)C)nn1 Show InChI InChI=1S/C22H29FN7O4PS/c1-29(2)21-10-6-18(7-11-21)25-26-19-8-12-22(13-9-19)36(32,33)24-16-20-17-30(28-27-20)14-4-5-15-35(23,31)34-3/h6-13,17,24H,4-5,14-16H2,1-3H3/b26-25+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5283334
Show SMILES COP(F)(=O)CCCn1cc(CNS(=O)(=O)c2cccc3c(cccc23)N(C)C)nn1 Show InChI InChI=1S/C19H25FN5O4PS/c1-24(2)18-9-4-8-17-16(18)7-5-10-19(17)31(27,28)21-13-15-14-25(23-22-15)11-6-12-30(20,26)29-3/h4-5,7-10,14,21H,6,11-13H2,1-3H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5283185
Show InChI InChI=1S/C5H11FN3O2P/c1-11-12(6,10)5-3-2-4-8-9-7/h2-5H2,1H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5272698
Show SMILES CCN(CC)c1ccc2c(-c3ccc(cc3S([O-])(=O)=O)S(=O)(=O)NCc3cn(CCCCP(F)(=O)OC)nn3)c3ccc(cc3oc2c1)=[N+](CC)CC |(-1.11,2.46,;.23,1.69,;1.56,2.46,;1.56,4,;.23,4.77,;2.89,1.69,;2.89,.15,;4.23,-.62,;5.56,.15,;6.89,-.62,;6.89,-2.16,;8.23,-2.93,;8.23,-4.47,;6.89,-5.24,;5.56,-4.47,;5.56,-2.93,;4.23,-2.16,;2.89,-1.39,;3.46,-3.49,;5,-.83,;6.89,-6.78,;6.89,-8.32,;8.43,-6.78,;5.35,-6.78,;4.58,-8.11,;3.04,-8.11,;2.14,-9.36,;.67,-8.88,;-.57,-9.79,;-1.98,-9.16,;-3.22,-10.07,;-4.63,-9.44,;-5.88,-10.35,;-6.78,-9.1,;-4.97,-11.59,;-7.12,-11.25,;-8.53,-10.62,;.67,-7.34,;2.14,-6.87,;8.23,.15,;9.56,-.62,;10.9,.15,;10.9,1.69,;9.56,2.46,;8.23,1.69,;6.89,2.46,;5.56,1.69,;4.23,2.46,;12.23,2.46,;12.23,4,;13.56,4.77,;13.56,1.69,;14.9,2.46,)| Show InChI InChI=1S/C35H44FN6O8PS2/c1-6-40(7-2)26-12-15-29-32(20-26)50-33-21-27(41(8-3)9-4)13-16-30(33)35(29)31-17-14-28(22-34(31)53(46,47)48)52(44,45)37-23-25-24-42(39-38-25)18-10-11-19-51(36,43)49-5/h12-17,20-22,24,37H,6-11,18-19,23H2,1-5H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | 5.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5281856
Show SMILES COP(F)(=O)CCCCn1cc(CNS(=O)(=O)c2ccc(C3=c4cc5CCC[N+]6=c5c(CCC6)c4Oc4c5CCCN6CCCc(cc34)c56)c(c2)S([O-])(=O)=O)nn1 |c:21,28| Show InChI InChI=1S/C39H44FN6O8PS2/c1-53-55(40,47)19-3-2-18-46-24-27(42-43-46)23-41-56(48,49)28-12-13-29(34(22-28)57(50,51)52)35-32-20-25-8-4-14-44-16-6-10-30(36(25)44)38(32)54-39-31-11-7-17-45-15-5-9-26(37(31)45)21-33(35)39/h12-13,20-22,24,41H,2-11,14-19,23H2,1H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | >5.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | CHEMBL5277870
Show SMILES COc1ccc2oc(=O)c(cc2c1)C(=O)NCc1cn(CCCCP(F)(=O)OC)nn1 Show InChI InChI=1S/C19H22FN4O6P/c1-28-15-5-6-17-13(9-15)10-16(19(26)30-17)18(25)21-11-14-12-24(23-22-14)7-3-4-8-31(20,27)29-2/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,21,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200723
(US9233086, 10L)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H49F2N7O4/c1-5-34(6-2,43-29(45)22(3)4)31(47)41-27(10-9-21-40-33(38)39)30(46)44-35(19-7-8-20-35)32(48)42-28(23-11-15-25(36)16-12-23)24-13-17-26(37)18-14-24/h11-18,22,27-28H,5-10,19-21H2,1-4H3,(H,41,47)(H,42,48)(H,43,45)(H,44,46)(H4,38,39,40)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617530
(US20230286925, Compound HYBI_087)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NC1CCN(C)CC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200712
(US9233086, 10A)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C35H51N7O4/c1-5-34(6-2,41-29(43)24(3)4)31(45)39-27(20-15-23-38-33(36)37)30(44)42-35(21-13-14-22-35)32(46)40-28(25-16-9-7-10-17-25)26-18-11-8-12-19-26/h7-12,16-19,24,27-28H,5-6,13-15,20-23H2,1-4H3,(H,39,45)(H,40,46)(H,41,43)(H,42,44)(H4,36,37,38)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
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 |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A/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
UniProtKB/SwissProt
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
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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/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
UniProtKB/SwissProt
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
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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/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
UniProtKB/SwissProt
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
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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/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
UniProtKB/SwissProt
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
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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617532
(US20230286925, Compound HYBI_110)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCC1CCCCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617525
(US20230286925, Compound HYBI_083)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)N1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.08 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617531
(US20230286925, Compound HYBI_101)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCN(C)CC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.65 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617528
(US20230286925, Compound HYBI_085)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NC1CCCCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.86 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617529
(US20230286925, Compound HYBI_086)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NC1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.99 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM470580
(US10815241, Example 5 | US11369605, Example 5)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
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 4.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM200722
(US9233086, 10K)Show SMILES CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C35H49Cl2N7O4/c1-5-34(6-2,43-29(45)22(3)4)31(47)41-27(10-9-21-40-33(38)39)30(46)44-35(19-7-8-20-35)32(48)42-28(23-11-15-25(36)16-12-23)24-13-17-26(37)18-14-24/h11-18,22,27-28H,5-10,19-21H2,1-4H3,(H,41,47)(H,42,48)(H,43,45)(H,44,46)(H4,38,39,40)/t27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description
Inhibition of MLL1 binding to N-terminal His-tagged WRD5 23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli Roset... |
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 | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617526
(US20230286925, Compound HYBI_084)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)N1CCN(C)CC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.72 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617524
(US20230286925, Compound HYBI_082)Show SMILES CCN(CC)C(=O)c1cn(nn1)-c1cc(NC(=O)c2cc(N)c(F)c(C)c2Cl)c(cc1F)N1C[C@H](C)N(C)[C@H](C)C1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.91 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617511
(US20230286925, Compound HYBI_028)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.24 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM558847
(2-[(4-{7-[(1S,3S,4R,6S)-6-(Cyclopropylmethyl)-2-az...)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@@H]2CC1CC1 |r,TLB:32:34:40.41:37.38,THB:42:41:34.35:37.38| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 5.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554135
(US11325921, Example 22)Show SMILES [H][C@@]12C[C@H](F)[C@@]([H])(C1)[C@H](N2)C(=O)N1CC2(C1)CN(C2)c1c(cnc2sc(CC(F)(F)F)cc12)C#N |r,THB:10:8:7:2.3,4:3:8.9:7| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM470584
(US10815241, Example 9 | US11369605, Example 9)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]2CC3=C)C1 Show InChI InChI=1S/C31H39FN6O3/c1-18(2)38(19(3)4)29(39)23-11-22(32)7-9-25(23)41-26-12-33-17-34-28(26)36-13-31(14-36)15-37(16-31)30(40)27-21-6-8-24(35-27)20(5)10-21/h7,9,11-12,17-19,21,24,27,35H,5-6,8,10,13-16H2,1-4H3/t21-,24+,27+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM470586
(US10815241, Example 11 | US11369605, Example 11)Show SMILES CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CN(C2)C(=O)C2NC3CCC2CC3)C1 |(-9.34,-3.59,;-8,-4.36,;-6.67,-3.59,;-8,-5.9,;-9.34,-6.67,;-10.67,-5.9,;-9.34,-8.21,;-6.67,-6.67,;-5.33,-5.9,;-6.67,-8.21,;-8,-8.98,;-8,-10.52,;-9.34,-11.29,;-6.67,-11.29,;-5.33,-10.52,;-5.33,-8.98,;-4,-8.21,;-2.67,-8.98,;-2.67,-10.52,;-1.33,-11.29,;,-10.52,;,-8.98,;-1.33,-8.21,;-1.33,-6.67,;-.24,-5.58,;-1.33,-4.49,;-.24,-3.4,;-1.33,-2.31,;-2.42,-3.4,;-1.33,-.77,;-2.67,,;;,1.54,;1.33,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;1.08,.26,;1.08,1.28,;-2.42,-5.58,)| Show InChI InChI=1S/C30H39FN6O3/c1-18(2)37(19(3)4)28(38)23-11-21(31)7-10-24(23)40-25-12-32-17-33-27(25)35-13-30(14-35)15-36(16-30)29(39)26-20-5-8-22(34-26)9-6-20/h7,10-12,17-20,22,26,34H,5-6,8-9,13-16H2,1-4H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617507
(US20230286925, Compound HYBI_021)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1ccc(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.09 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM470579
(US10815241, Example 4 | US11369605, Example 4)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@H]2CC1CC1 Show InChI InChI=1S/C36H49FN6O3/c1-22(2)43(23(3)4)34(44)28-17-27(37)8-10-30(28)46-31-18-38-21-39-33(31)42-19-36(20-42)11-13-41(14-12-36)35(45)32-25-7-9-29(40-32)26(16-25)15-24-5-6-24/h8,10,17-18,21-26,29,32,40H,5-7,9,11-16,19-20H2,1-4H3/t25-,26-,29+,32+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617679
(US20230286948, Compound HYBI-070)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(F)c(cc1NC(=O)c1c[nH]c(=O)cc1C(F)(F)F)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.23 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2NS1018 |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM470583
(US10815241, Example 8 | US11369605, Example 8)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]1CC2=C Show InChI InChI=1S/C33H43FN6O3/c1-20(2)40(21(3)4)31(41)25-15-24(34)7-9-27(25)43-28-16-35-19-36-30(28)39-17-33(18-39)10-12-38(13-11-33)32(42)29-23-6-8-26(37-29)22(5)14-23/h7,9,15-16,19-21,23,26,29,37H,5-6,8,10-14,17-18H2,1-4H3/t23-,26+,29+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 7.90 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| 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... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2X63R5J |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617506
(US20230286925, Compound HYBI_020)Show SMILES C[C@H]1CN(CCN1C)c1ccc(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.23 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554134
(US11325921, Example 21)Show SMILES FC(F)(F)Cc1cc2c(N3CC4(CN(C4)C(=O)[C@@H]4N[C@@H]5CC[C@H]4C5)C3)c(cnc2s1)C#N |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 8.40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617674
(US20230286948, Compound HYBI-064)Show SMILES C[C@H]1CN(CCN1C)c1ccc(cc1NC(=O)c1c[nH]c(=O)cc1C(F)(F)F)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2NS1018 |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617500
(US20230286925, Compound HYBI_010)Show SMILES COc1ccc(COC(=O)c2cn(nn2)-c2ccc(N3CCN(C)CC3)c(NC(=O)c3cc(N)c(F)c(C)c3Cl)c2)cc1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.62 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617510
(US20230286925, Compound HYBI_027)Show SMILES CC1CN(CCN1C)c1cc(F)c(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 10.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554136
(US11325921, Example 23)Show SMILES [H][C@@]12C[C@@]([H])([C@H](N1)C(=O)N1CC3(C1)CN(C3)c1c(cnc3sc(CC(F)(F)F)cc13)C#N)C(F)(F)C2 |r,TLB:7:5:2:35.32| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554133
(US11325921, Example 20)Show SMILES FC(F)(F)Cc1cc2c(N3CC4(CN(C4)C(=O)[C@H]4N[C@@H]5CC[C@H]4C5)C3)c(cnc2s1)C#N |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 11.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554059
(US11325921, Example 1)Show SMILES [H][C@]12CC[C@]([H])([C@@H](F)C1)[C@H](N2)C(=O)N1CC2(C1)CN(C2)c1c(cnc2sc(CC(F)(F)F)cc12)C(F)(F)F | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 13.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617499
(US20230286925, Compound HYBI_003)Show SMILES CC(C)COC(=O)c1cn(nn1)-c1ccc(N2CCN(C)CC2)c(NC(=O)c2cc(N)c(F)c(C)c2Cl)c1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 15.6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617676
(US20230286948, Compound HYBI-065)Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1ccc(cc1NC(=O)c1cnc(Cl)cc1C(F)(F)F)-n1cc(nn1)C(=O)NCCCN1CCOCC1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 16.6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2NS1018 |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617503
(US20230286925, Compound HYBI_018)Show SMILES CN1CCN(CC1)c1ccc(cc1NC(=O)c1cc(N)c(F)c(C)c1Cl)-n1cc(nn1)C(=O)OC1(C)CCC1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 16.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617505
(US20230286925, Compound HYBI_019A)Show SMILES CN(CCCO)C(=O)c1cn(nn1)-c1ccc(N2CCN(C)CC2)c(NC(=O)c2cc(N)c(F)c(C)c2Cl)c1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 17.1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A/Menin
(Homo sapiens (Human)) | BDBM554111
(US11325921, Example 2 | US11325921, Example 9)Show SMILES [H][C@@]12C[C@H](F)[C@@]([H])(C1)[C@H](N2)C(=O)N1CC2(C1)CN(C2)c1c(cnc2sc(CC(F)(F)F)cc12)C(F)(F)F | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 17.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Test for Evaluating the Inbinition of the Menin-MLL BindingMenin1-615 wherein 6× His tag and HA tag are inserted in the N-terminus, and myc tag is in... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2K64N9C |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617523
(US20230286925, Compound HYBI_053)Show SMILES CN1CCN(CC1)c1cc(F)c(cc1NC(=O)c1ccc(F)c(C)c1Cl)-n1cc(nn1)C(=O)NCCCN1CCOCC1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Histone-lysine N-methyltransferase 2A
(Homo sapiens (Human)) | BDBM617501
(US20230286925, Compound HYBI_013)Show SMILES CCOC(=O)[C@H](C)OC(=O)c1cn(nn1)-c1ccc(N2CCN(C)CC2)c(NC(=O)c2cc(N)c(F)c(C)c2Cl)c1 |r| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2222ZXC |
More data for this
Ligand-Target Pair | |
Search and Browse
