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52 similar compounds to monomer 50025607

Compile data set for download or QSAR
Wt: 411.4
BDBM50183475
Wt: 425.4
BDBM50240660
Wt: 397.3
BDBM50025605
Wt: 428.5
BDBM50025615
Wt: 428.5
BDBM50025617
Wt: 470.5
BDBM50025618
Wt: 365.3
BDBM50025606
Purchase
Wt: 330.3
BDBM50025608
Wt: 314.2
BDBM50025620
Wt: 300.2
BDBM50025622
Purchase
Wt: 194.1
BDBM50025624
Purchase
Wt: 314.2
BDBM50025610
Wt: 328.2
BDBM50025611
Wt: 342.2
BDBM50025613
Wt: 432.3
BDBM50025604
Displayed 1 to 15 (of 52 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50183475,50240660,50025605,50025615,50025617,50025618,50025606,50025608,50025620,50025622,50025624,50025610,50025611,50025613,50025604   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50183475
PNG
(5-(3-Amino-propylamino)-7,10-dihydroxy-2-[2-(2-hyd...)
Show SMILES NCCCNc1ccc2n(CCNCCO)nc3-c4c(O)ccc(O)c4C(=O)c1c23
Show InChI InChI=1S/C21H25N5O4/c22-6-1-7-24-12-2-3-13-17-16(12)21(30)19-15(29)5-4-14(28)18(19)20(17)25-26(13)10-8-23-9-11-27/h2-5,23-24,27-29H,1,6-11,22H2
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n/an/a 1.80E+4n/an/an/an/an/an/a



University of Houston

Curated by ChEMBL


Assay Description
Inhibition of 3'-processing activity of HIV1 integrase


J Med Chem 49: 1684-92 (2006)


Article DOI: 10.1021/jm0510629
BindingDB Entry DOI: 10.7270/Q2V987NX
More data for this
Ligand-Target Pair
Topoisomerase II alpha (HuTopoIIα)


(Homo sapiens (Human))
BDBM50240660
PNG
(7-Hydroxy-2-[2-(2-hydroxy-ethylamino)-ethyl]-5-[2-...)
Show SMILES OCCNCCNc1ccc2n(CCNCCO)nc3-c4cccc(O)c4C(=O)c1c23
Show InChI InChI=1S/C22H27N5O4/c28-12-9-23-6-7-25-15-4-5-16-20-19(15)22(31)18-14(2-1-3-17(18)30)21(20)26-27(16)11-8-24-10-13-29/h1-5,23-25,28-30H,6-13H2
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n/an/a 7.30E+3n/an/an/an/an/an/a



University of Manitoba

Curated by ChEMBL


Assay Description
Inhibition of human topoisomerase 2alpha decantation activity


Bioorg Med Chem 16: 3959-68 (2008)


Article DOI: 10.1016/j.bmc.2008.01.033
BindingDB Entry DOI: 10.7270/Q2T72H7K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50025617
PNG
(CHEMBL491389)
Show SMILES COc1cc(cc(OC)c1O[Si](C)(C)C(C)(C)C)-c1cc(=O)c2cc(O)ccc2o1
Show InChI InChI=1S/C23H28O6Si/c1-23(2,3)30(6,7)29-22-20(26-4)10-14(11-21(22)27-5)19-13-17(25)16-12-15(24)8-9-18(16)28-19/h8-13,24H,1-7H3
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025624
PNG
(CHEMBL17329 | Methyl 2,5-Dihydroxycinnamate | Meth...)
Show SMILES COC(=O)\C=C\c1cc(O)ccc1O
Show InChI InChI=1S/C10H10O4/c1-14-10(13)5-2-7-6-8(11)3-4-9(7)12/h2-6,11-12H,1H3/b5-2+
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025606
PNG
(LAVENDUSTIN B)
Show SMILES OC(=O)c1cc(ccc1O)N(Cc1ccccc1O)Cc1ccccc1O
Show InChI InChI=1S/C21H19NO5/c23-18-7-3-1-5-14(18)12-22(13-15-6-2-4-8-19(15)24)16-9-10-20(25)17(11-16)21(26)27/h1-11,23-25H,12-13H2,(H,26,27)
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR in human A431 cells


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025605
PNG
(CHEMBL483830)
Show SMILES OC(=O)c1cc(ccc1O)N(Cc1cc(O)ccc1O)Cc1cc(O)ccc1O
Show InChI InChI=1S/C21H19NO7/c23-15-2-5-18(25)12(7-15)10-22(11-13-8-16(24)3-6-19(13)26)14-1-4-20(27)17(9-14)21(28)29/h1-9,23-27H,10-11H2,(H,28,29)
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n/an/a 1n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR in human A431 cells


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025620
PNG
(CHEMBL443171)
Show SMILES OC(=O)c1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(O)cc1
Show InChI InChI=1S/C16H10O7/c17-8-3-1-7(2-4-8)12-14(20)13-10(19)5-9(18)6-11(13)23-15(12)16(21)22/h1-6,17-19H,(H,21,22)
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50025615
PNG
(CHEMBL489762)
Show SMILES COc1cc(cc(OC)c1O[Si](C)(C)C(C)(C)C)-c1cc(=O)c2ccc(O)cc2o1
Show InChI InChI=1S/C23H28O6Si/c1-23(2,3)30(6,7)29-22-20(26-4)10-14(11-21(22)27-5)18-13-17(25)16-9-8-15(24)12-19(16)28-18/h8-13,24H,1-7H3
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n/an/a 7n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50025610
PNG
(CHEMBL489764)
Show SMILES COc1cc(cc(OC)c1O)-c1cc(=O)c2ccc(O)cc2o1
Show InChI InChI=1S/C17H14O6/c1-21-15-5-9(6-16(22-2)17(15)20)13-8-12(19)11-4-3-10(18)7-14(11)23-13/h3-8,18,20H,1-2H3
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n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025608
PNG
(CHEMBL490960)
Show SMILES CSCc1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(O)cc1
Show InChI InChI=1S/C17H14O5S/c1-23-8-14-15(9-2-4-10(18)5-3-9)17(21)16-12(20)6-11(19)7-13(16)22-14/h2-7,18-20H,8H2,1H3
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50025618
PNG
(CHEMBL519695)
Show SMILES COc1cc(cc(OC)c1O[Si](C)(C)C(C)(C)C)-c1cc(=O)c2ccc(OC(C)=O)cc2o1
Show InChI InChI=1S/C25H30O7Si/c1-15(26)30-17-9-10-18-19(27)14-20(31-21(18)13-17)16-11-22(28-5)24(23(12-16)29-6)32-33(7,8)25(2,3)4/h9-14H,1-8H3
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n/an/a>8n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50025604
PNG
(CHEMBL522084)
Show SMILES Cc1cc(O)c2C(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1
Show InChI InChI=1S/C21H20O10/c1-7-2-9-14(11(23)3-7)18(27)15-10(16(9)25)4-8(5-12(15)24)30-21-20(29)19(28)17(26)13(6-22)31-21/h2-5,13,17,19-24,26,28-29H,6H2,1H3/t13-,17-,19+,20-,21-/m1/s1
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n/an/a>8n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025613
PNG
(CHEMBL489139)
Show SMILES CCOC(=O)c1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(O)cc1
Show InChI InChI=1S/C18H14O7/c1-2-24-18(23)17-14(9-3-5-10(19)6-4-9)16(22)15-12(21)7-11(20)8-13(15)25-17/h3-8,19-21H,2H2,1H3
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025622
PNG
(PSI-TECTORIGENIN | Psi-Tectorigenin)
Show SMILES COc1c(O)cc(O)c2c1occ(-c1ccc(O)cc1)c2=O
Show InChI InChI=1S/C16H12O6/c1-21-15-12(19)6-11(18)13-14(20)10(7-22-16(13)15)8-2-4-9(17)5-3-8/h2-7,17-19H,1H3
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n/an/a 1n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR in human A431 cells


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50025611
PNG
(CHEMBL522082)
Show SMILES COC(=O)c1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(O)cc1
Show InChI InChI=1S/C17H12O7/c1-23-17(22)16-13(8-2-4-9(18)5-3-8)15(21)14-11(20)6-10(19)7-12(14)24-16/h2-7,18-20H,1H3
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of EGFR


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Topoisomerase II alpha (HuTopoIIα)


(Homo sapiens (Human))
BDBM50183475
PNG
(5-(3-Amino-propylamino)-7,10-dihydroxy-2-[2-(2-hyd...)
Show SMILES NCCCNc1ccc2n(CCNCCO)nc3-c4c(O)ccc(O)c4C(=O)c1c23
Show InChI InChI=1S/C21H25N5O4/c22-6-1-7-24-12-2-3-13-17-16(12)21(30)19-15(29)5-4-14(28)18(19)20(17)25-26(13)10-8-23-9-11-27/h2-5,23-24,27-29H,1,6-11,22H2
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n/an/a 4.60E+3n/an/an/an/an/an/a



University of Manitoba

Curated by ChEMBL


Assay Description
Inhibition of human topoisomerase 2alpha decantation activity


Bioorg Med Chem 16: 3959-68 (2008)


Article DOI: 10.1016/j.bmc.2008.01.033
BindingDB Entry DOI: 10.7270/Q2T72H7K
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50183475
PNG
(5-(3-Amino-propylamino)-7,10-dihydroxy-2-[2-(2-hyd...)
Show SMILES NCCCNc1ccc2n(CCNCCO)nc3-c4c(O)ccc(O)c4C(=O)c1c23
Show InChI InChI=1S/C21H25N5O4/c22-6-1-7-24-12-2-3-13-17-16(12)21(30)19-15(29)5-4-14(28)18(19)20(17)25-26(13)10-8-23-9-11-27/h2-5,23-24,27-29H,1,6-11,22H2
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n/an/a 9.00E+3n/an/an/an/an/an/a



University of Houston

Curated by ChEMBL


Assay Description
Inhibition of strand transfer activity of HIV1 integrase


J Med Chem 49: 1684-92 (2006)


Article DOI: 10.1021/jm0510629
BindingDB Entry DOI: 10.7270/Q2V987NX
More data for this
Ligand-Target Pair