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7 similar compounds to monomer 50264469

Compile data set for download or QSAR
Wt: 913.0
BDBM50264465
Wt: 943.0
BDBM50264466
Wt: 912.0
BDBM50264467
Wt: 960.9
BDBM50264461
Wt: 912.0
BDBM50264468
Wt: 927.0
BDBM50264470
Wt: 988.0
BDBM50264462

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50264465,50264466,50264467,50264461,50264468,50264470,50264462   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Grb2-SH2


(Homo sapiens (Human))
BDBM50264470
PNG
(CHEMBL500357 | N-Fmoc-(S)-(alpha-Me)Adi-Leu-(3'-NH...)
Show SMILES CC(C)C[C@H](NC(=O)[C@](C)(CCCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)c(N)c1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C48H62N8O11/c1-27(2)22-36(54-44(64)47(3,19-11-16-40(59)60)56-46(66)67-26-33-31-14-7-5-12-29(31)30-13-6-8-15-32(30)33)42(62)52-37(24-28-17-18-38(57)34(49)23-28)43(63)55-48(20-9-4-10-21-48)45(65)53-35(41(51)61)25-39(50)58/h5-8,12-15,17-18,23,27,33,35-37,57H,4,9-11,16,19-22,24-26,49H2,1-3H3,(H2,50,58)(H2,51,61)(H,52,62)(H,53,65)(H,54,64)(H,55,63)(H,56,66)(H,59,60)/t35-,36-,37-,47-/m0/s1
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PubMed
n/an/a 3.90E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264468
PNG
(CHEMBL461032 | N-Fmoc-(S)-(alpha-Me)Adi-Leu-Tyr-Ac...)
Show SMILES CC(C)C[C@H](NC(=O)[C@](C)(CCCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C48H61N7O11/c1-28(2)24-37(53-44(63)47(3,21-11-16-40(58)59)55-46(65)66-27-35-33-14-7-5-12-31(33)32-13-6-8-15-34(32)35)42(61)51-38(25-29-17-19-30(56)20-18-29)43(62)54-48(22-9-4-10-23-48)45(64)52-36(41(50)60)26-39(49)57/h5-8,12-15,17-20,28,35-38,56H,4,9-11,16,21-27H2,1-3H3,(H2,49,57)(H2,50,60)(H,51,61)(H,52,64)(H,53,63)(H,54,62)(H,55,65)(H,58,59)/t36-,37-,38-,47-/m0/s1
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n/an/a 1.18E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264467
PNG
(CHEMBL448312 | N-Fmoc-(R)-(alpha-Me)Adi-Leu-Tyr-Ac...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@](C)(CCCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C48H61N7O11/c1-28(2)24-37(53-44(63)47(3,21-11-16-40(58)59)55-46(65)66-27-35-33-14-7-5-12-31(33)32-13-6-8-15-34(32)35)42(61)51-38(25-29-17-19-30(56)20-18-29)43(62)54-48(22-9-4-10-23-48)45(64)52-36(41(50)60)26-39(49)57/h5-8,12-15,17-20,28,35-38,56H,4,9-11,16,21-27H2,1-3H3,(H2,49,57)(H2,50,60)(H,51,61)(H,52,64)(H,53,63)(H,54,62)(H,55,65)(H,58,59)/t36-,37-,38-,47+/m0/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264461
PNG
(CHEMBL508925 | N-Fmoc-Gla-Leu-(3'-NH2-Tyr)-(alpha-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C(O)=O)C(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)c(N)c1)C(=O)N[C@@](C)(CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C46H56N8O15/c1-22(2)16-32(50-40(61)34(19-28(42(63)64)43(65)66)53-45(68)69-21-29-26-10-6-4-8-24(26)25-9-5-7-11-27(25)29)39(60)51-33(18-23-12-13-35(55)30(47)17-23)41(62)54-46(3,15-14-37(57)58)44(67)52-31(38(49)59)20-36(48)56/h4-13,17,22,28-29,31-34,55H,14-16,18-21,47H2,1-3H3,(H2,48,56)(H2,49,59)(H,50,61)(H,51,60)(H,52,67)(H,53,68)(H,54,62)(H,57,58)(H,63,64)(H,65,66)/t31-,32-,33-,34-,46-/m0/s1
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n/an/a 4.40E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264465
PNG
(CHEMBL462230 | N-Fmoc-Adi-Leu-(3'-NH2-Tyr)-Ac6c-Gl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)c(N)c1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C47H60N8O11/c1-26(2)21-36(51-42(61)34(15-10-16-40(58)59)54-46(65)66-25-32-30-13-6-4-11-28(30)29-12-5-7-14-31(29)32)43(62)52-37(23-27-17-18-38(56)33(48)22-27)44(63)55-47(19-8-3-9-20-47)45(64)53-35(41(50)60)24-39(49)57/h4-7,11-14,17-18,22,26,32,34-37,56H,3,8-10,15-16,19-21,23-25,48H2,1-2H3,(H2,49,57)(H2,50,60)(H,51,61)(H,52,62)(H,53,64)(H,54,65)(H,55,63)(H,58,59)/t34-,35-,36-,37-/m0/s1
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PubMed
n/an/a 5.80E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264462
PNG
(CHEMBL445342 | N-Fmoc-Adi-Leu-(3'-CH2CH2CO2H-Tyr)-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)c(CCC(O)=O)c1)C(=O)N[C@@](C)(CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C49H61N7O15/c1-26(2)21-36(52-44(66)34(13-8-14-40(59)60)55-48(70)71-25-33-31-11-6-4-9-29(31)30-10-5-7-12-32(30)33)45(67)53-37(23-27-15-17-38(57)28(22-27)16-18-41(61)62)46(68)56-49(3,20-19-42(63)64)47(69)54-35(43(51)65)24-39(50)58/h4-7,9-12,15,17,22,26,33-37,57H,8,13-14,16,18-21,23-25H2,1-3H3,(H2,50,58)(H2,51,65)(H,52,66)(H,53,67)(H,54,69)(H,55,70)(H,56,68)(H,59,60)(H,61,62)(H,63,64)/t34-,35-,36-,37-,49-/m0/s1
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n/an/a 5.60E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair
Grb2-SH2


(Homo sapiens (Human))
BDBM50264466
PNG
(CHEMBL444948 | N-Fmoc-Gla-Leu-(3'-NH2-Tyr)-Ac6c-Gl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C(O)=O)C(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)c(N)c1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C47H58N8O13/c1-24(2)18-34(51-41(60)36(21-30(43(62)63)44(64)65)54-46(67)68-23-31-28-12-6-4-10-26(28)27-11-5-7-13-29(27)31)40(59)52-35(20-25-14-15-37(56)32(48)19-25)42(61)55-47(16-8-3-9-17-47)45(66)53-33(39(50)58)22-38(49)57/h4-7,10-15,19,24,30-31,33-36,56H,3,8-9,16-18,20-23,48H2,1-2H3,(H2,49,57)(H2,50,58)(H,51,60)(H,52,59)(H,53,66)(H,54,67)(H,55,61)(H,62,63)(H,64,65)/t33-,34-,35-,36-/m0/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to recombinant Grb2 SH2 domain by surface plasmon resonance analysis


J Med Chem 51: 6371-80 (2008)


Article DOI: 10.1021/jm800487r
BindingDB Entry DOI: 10.7270/Q2XG9S2N
More data for this
Ligand-Target Pair