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PubMed code 19743866

Compile data set for download or QSAR
Found 16 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Complement factor B


(Homo sapiens (Human))
BDBM50314023
PNG
((6S,9S,12S,15S,18S,21S)-21-acetamido-1,26-diamino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C36H68N12O8/c1-19(2)16-25(30(52)43-21(5)28(50)45-24(33(55)56)13-11-15-42-35(39)40)47-32(54)27(18-36(7,8)9)48-31(53)26(17-20(3)4)46-29(51)23(44-22(6)49)12-10-14-41-34(37)38/h19-21,23-27H,10-18H2,1-9H3,(H,43,52)(H,44,49)(H,45,50)(H,46,51)(H,47,54)(H,48,53)(H,55,56)(H4,37,38,41)(H4,39,40,42)/t21-,23-,24-,25-,26-,27-/m0/s1
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n/an/a 250n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314024
PNG
((6S,9S,12S,15S,18S,21S)-21-acetamido-1,26-diamino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C35H66N12O8/c1-18(2)15-25(30(51)42-21(7)28(49)44-24(33(54)55)12-10-14-41-35(38)39)46-32(53)27(17-20(5)6)47-31(52)26(16-19(3)4)45-29(50)23(43-22(8)48)11-9-13-40-34(36)37/h18-21,23-27H,9-17H2,1-8H3,(H,42,51)(H,43,48)(H,44,49)(H,45,50)(H,46,53)(H,47,52)(H,54,55)(H4,36,37,40)(H4,38,39,41)/t21-,23-,24-,25-,26-,27-/m0/s1
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n/an/a 600n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314028
PNG
((6S,9S,12S,15S,18S,21S)-21-((1H-imidazol-5-yl)meth...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C35H61N11O8/c1-18(2)12-25(30(49)41-21(7)29(48)43-24(34(53)54)10-9-11-39-35(36)37)44-31(50)26(13-19(3)4)45-32(51)27(14-20(5)6)46-33(52)28(42-22(8)47)15-23-16-38-17-40-23/h16-21,24-28H,9-15H2,1-8H3,(H,38,40)(H,41,49)(H,42,47)(H,43,48)(H,44,50)(H,45,51)(H,46,52)(H,53,54)(H4,36,37,39)/t21-,24-,25-,26-,27-,28-/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314027
PNG
((6S,9S,12S,15S,18S)-1-amino-1-imino-12,15,18-triis...)
Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C29H54N8O7/c1-15(2)12-21(34-19(8)38)26(41)37-23(14-17(5)6)27(42)36-22(13-16(3)4)25(40)33-18(7)24(39)35-20(28(43)44)10-9-11-32-29(30)31/h15-18,20-23H,9-14H2,1-8H3,(H,33,40)(H,34,38)(H,35,39)(H,36,42)(H,37,41)(H,43,44)(H4,30,31,32)/t18-,20-,21-,22-,23-/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314033
PNG
((6S,9S,12S,15S,18S,21S,24S)-21-((1H-imidazol-5-yl)...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C38H66N12O10/c1-19(2)12-26(32(54)44-22(7)31(53)46-25(37(59)60)10-9-11-42-38(39)40)47-33(55)27(13-20(3)4)48-34(56)28(14-21(5)6)49-35(57)29(15-24-16-41-18-43-24)50-36(58)30(17-51)45-23(8)52/h16,18-22,25-30,51H,9-15,17H2,1-8H3,(H,41,43)(H,44,54)(H,45,52)(H,46,53)(H,47,55)(H,48,56)(H,49,57)(H,50,58)(H,59,60)(H4,39,40,42)/t22-,25-,26-,27-,28-,29-,30-/m0/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314031
PNG
((6S,9S,12S,15S,18S,21S,24S)-21-((1H-imidazol-5-yl)...)
Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C38H66N12O10/c1-8-9-11-25(46-35(57)29(16-24-17-41-19-43-24)50-36(58)30(18-51)45-23(7)52)32(54)48-28(15-21(4)5)34(56)49-27(14-20(2)3)33(55)44-22(6)31(53)47-26(37(59)60)12-10-13-42-38(39)40/h17,19-22,25-30,51H,8-16,18H2,1-7H3,(H,41,43)(H,44,55)(H,45,52)(H,46,57)(H,47,53)(H,48,54)(H,49,56)(H,50,58)(H,59,60)(H4,39,40,42)/t22-,25-,26-,27-,28-,29-,30-/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314032
PNG
((2S,5S,8S,11S,14S,17S,20S)-17-((1H-imidazol-5-yl)m...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C40H70N12O9/c1-22(2)16-30(36(57)47-24(5)33(54)49-29(39(60)61)12-9-15-45-40(42)43)51-35(56)28(14-13-25-10-7-6-8-11-25)48-37(58)31(17-23(3)4)52-38(59)32(18-26-19-44-21-46-26)50-34(55)27(41)20-53/h19,21-25,27-32,53H,6-18,20,41H2,1-5H3,(H,44,46)(H,47,57)(H,48,58)(H,49,54)(H,50,55)(H,51,56)(H,52,59)(H,60,61)(H4,42,43,45)/t24-,27-,28-,29-,30-,31-,32-/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314025
PNG
((6S,12S,15S,18S,21S)-21-acetamido-1,26-diamino-1,2...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C34H64N12O8/c1-18(2)14-24(28(49)41-17-27(48)43-23(32(53)54)11-9-13-40-34(37)38)44-30(51)26(16-20(5)6)46-31(52)25(15-19(3)4)45-29(50)22(42-21(7)47)10-8-12-39-33(35)36/h18-20,22-26H,8-17H2,1-7H3,(H,41,49)(H,42,47)(H,43,48)(H,44,51)(H,45,50)(H,46,52)(H,53,54)(H4,35,36,39)(H4,37,38,40)/t22-,23-,24-,25-,26-/m0/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314023
PNG
((6S,9S,12S,15S,18S,21S)-21-acetamido-1,26-diamino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C36H68N12O8/c1-19(2)16-25(30(52)43-21(5)28(50)45-24(33(55)56)13-11-15-42-35(39)40)47-32(54)27(18-36(7,8)9)48-31(53)26(17-20(3)4)46-29(51)23(44-22(6)49)12-10-14-41-34(37)38/h19-21,23-27H,10-18H2,1-9H3,(H,43,52)(H,44,49)(H,45,50)(H,46,51)(H,47,54)(H,48,53)(H,55,56)(H4,37,38,41)(H4,39,40,42)/t21-,23-,24-,25-,26-,27-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human C3 convertase assessed as inhibition of C3a and C3b fragment production at pH 7.4 after 30 mins by SDS-PAGE


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50241352
PNG
(2-[(4R,7S,10S,13S,19S,22S,25S,28S,31S,34R)-34-[(2S...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
Show InChI InChI=1S/C66H99N23O17S2/c1-8-32(6)50(68)63(104)86-46-27-108-107-26-45(62(103)89-53(33(7)90)54(69)95)85-56(97)39(14-11-17-74-66(70)71)80-59(100)43(20-36-24-73-29-78-36)83-58(99)42(19-35-23-72-28-77-35)79-48(92)25-76-55(96)41(18-34-22-75-38-13-10-9-12-37(34)38)82-60(101)44(21-49(93)94)84-57(98)40(15-16-47(67)91)81-64(105)51(30(2)3)88-65(106)52(31(4)5)87-61(46)102/h9-10,12-13,22-24,28-33,39-46,50-53,75,90H,8,11,14-21,25-27,68H2,1-7H3,(H2,67,91)(H2,69,95)(H,72,77)(H,73,78)(H,76,96)(H,79,92)(H,80,100)(H,81,105)(H,82,101)(H,83,99)(H,84,98)(H,85,97)(H,86,104)(H,87,102)(H,88,106)(H,89,103)(H,93,94)(H4,70,71,74)/t32-,33+,39-,40-,41-,42-,43-,44-,45-,46-,50-,51-,52-,53-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human C3/C5 convertase assessed as inhibition of C3 cleavage


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314026
PNG
((6S,9S,12S,15S)-1-amino-1-imino-12,15-diisobutyl-9...)
Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C23H43N7O6/c1-12(2)10-17(28-15(6)31)21(34)30-18(11-13(3)4)20(33)27-14(5)19(32)29-16(22(35)36)8-7-9-26-23(24)25/h12-14,16-18H,7-11H2,1-6H3,(H,27,33)(H,28,31)(H,29,32)(H,30,34)(H,35,36)(H4,24,25,26)/t14-,16-,17-,18-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314030
PNG
((6S,9S,12S,18S,21S,24S)-21-((1H-imidazol-5-yl)meth...)
Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccc(F)cc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C40H61FN12O9/c1-21(2)14-29(52-38(60)32(17-27-18-44-20-47-27)53-37(59)31(49-24(6)54)16-25-9-11-26(41)12-10-25)35(57)46-19-33(55)50-30(15-22(3)4)36(58)48-23(5)34(56)51-28(39(61)62)8-7-13-45-40(42)43/h9-12,18,20-23,28-32H,7-8,13-17,19H2,1-6H3,(H,44,47)(H,46,57)(H,48,58)(H,49,54)(H,50,55)(H,51,56)(H,52,60)(H,53,59)(H,61,62)(H4,42,43,45)/t23-,28-,29-,30-,31-,32-/m0/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314034
PNG
((6S,9S,12S,18S,21S,24S)-21-((1H-imidazol-5-yl)meth...)
Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C34H58N12O10/c1-17(2)10-23(45-31(53)25(12-21-13-37-16-40-21)46-32(54)26(15-47)42-20(6)48)29(51)39-14-27(49)43-24(11-18(3)4)30(52)41-19(5)28(50)44-22(33(55)56)8-7-9-38-34(35)36/h13,16-19,22-26,47H,7-12,14-15H2,1-6H3,(H,37,40)(H,39,51)(H,41,52)(H,42,48)(H,43,49)(H,44,50)(H,45,53)(H,46,54)(H,55,56)(H4,35,36,38)/t19-,22-,23-,24-,25-,26-/m0/s1
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n/an/a 1.90E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314035
PNG
((S)-2-[(S)-2-((S)-2-Acetylamino-3-hydroxy-propiony...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(C)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C40H62N14O11/c1-21(2)14-29(52-38(62)31(16-26-17-43-20-46-26)53-39(63)32(19-55)48-24(6)56)35(59)45-18-33(57)50-30(15-22(3)4)37(61)47-23(5)34(58)51-28(8-7-13-44-40(41)42)36(60)49-25-9-11-27(12-10-25)54(64)65/h9-12,17,20-23,28-32,55H,7-8,13-16,18-19H2,1-6H3,(H,43,46)(H,45,59)(H,47,61)(H,48,56)(H,49,60)(H,50,57)(H,51,58)(H,52,62)(H,53,63)(H4,41,42,44)/t23-,28-,29-,30-,31-,32-/m0/s1
UniProtKB/SwissProt

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UniChem
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n/an/a 1.90E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314029
PNG
((6S,9S,12S,18S,21S,24S)-21-((1H-imidazol-5-yl)meth...)
Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C40H62N12O9/c1-22(2)15-29(51-38(59)32(18-27-19-43-21-46-27)52-37(58)31(48-25(6)53)17-26-11-8-7-9-12-26)35(56)45-20-33(54)49-30(16-23(3)4)36(57)47-24(5)34(55)50-28(39(60)61)13-10-14-44-40(41)42/h7-9,11-12,19,21-24,28-32H,10,13-18,20H2,1-6H3,(H,43,46)(H,45,56)(H,47,57)(H,48,53)(H,49,54)(H,50,55)(H,51,59)(H,52,58)(H,60,61)(H4,41,42,44)/t24-,28-,29-,30-,31-,32-/m0/s1
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n/an/a 2.30E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human complement factor B treated for 5 mins before addition of substrate Ac-SHLGLAR-pNA at pH 9.5 by chromogenic assay


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM50314024
PNG
((6S,9S,12S,15S,18S,21S)-21-acetamido-1,26-diamino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
Show InChI InChI=1S/C35H66N12O8/c1-18(2)15-25(30(51)42-21(7)28(49)44-24(33(54)55)12-10-14-41-35(38)39)46-32(53)27(17-20(5)6)47-31(52)26(16-19(3)4)45-29(50)23(43-22(8)48)11-9-13-40-34(36)37/h18-21,23-27H,9-17H2,1-8H3,(H,42,51)(H,43,48)(H,44,49)(H,45,50)(H,46,53)(H,47,52)(H,54,55)(H4,36,37,40)(H4,38,39,41)/t21-,23-,24-,25-,26-,27-/m0/s1
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n/an/a 5.00E+4n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of human C3 convertase assessed as inhibition of C3a and C3b fragment production at pH 7.4 after 30 mins by SDS-PAGE


J Med Chem 52: 6042-52 (2009)


Article DOI: 10.1021/jm900781m
BindingDB Entry DOI: 10.7270/Q2W959BW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%