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Compile Data Set for Download or QSAR

Found 6 hits of ic50 for UniProtKB: P00740   
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
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50565732
PNG
(CHEMBL4782167)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]1([#8]-[#6@@H]-2-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#6]-[#8]S([#8-])(=O)=O)-[#8][C@@]([H])([#8]-[#6@H](-[#6@H](-[#8])-[#6](-[#8-])=O)-[#6@H](-[#8][C@]3([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]3-[#8]S([#8])(=O)=O)-[#6@@H](-[#8])-[#6]-[#8])[#6@@H]-2-[#7]-[#6](-[#6])=O)[#8]-[#6@@H](-[#6@@H](-[#8][C@]2([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8][C@]3([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]4([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8][C@]5([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]6([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8][C@]7([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]8([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]9([H])[#8]-[#6](=[#6]-[#6@H](-[#8][C@]%10([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]%10-[#8]S([#8])(=O)=O)-[#6@H]9-[#8])-[#6](-[#8-])=O)-[#6@H]8-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]8([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]8-[#8]S([#8])(=O)=O)-[#6@H]7-[#8])-[#6](-[#8-])=O)-[#6@H]6-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]6([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]6-[#8]S([#8])(=O)=O)-[#6@H]5-[#8])-[#6](-[#8-])=O)-[#6@H]4-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]4([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]4-[#8]S([#8])(=O)=O)-[#6@H]3-[#8])-[#6](-[#8-])=O)-[#6@H]2-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]2([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]2-[#8]S([#8])(=O)=O)-[#6@H]1-[#8])-[#6](-[#8-])=O |r,c:156|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human citrated plasma iXase (factor 8a-factor 9a complex) preincubated for 2 mins followed by factor 10 addition and measured after 1 m...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112796
BindingDB Entry DOI: 10.7270/Q28D0113
More data for this
Ligand-Target Pair
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50565731
PNG
(CHEMBL4786745)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]1([#8]-[#6@H](-[#6@@H](-[#8])-[#6]-[#8])-[#6@H](-[#8][C@]2([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]3([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]4([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]5([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]6([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]7([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]8([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]9([H])[#8]-[#6@@H](-[#6@@H](-[#8][C@]%10([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]%11([H])[#8]-[#6](=[#6]-[#6@H](-[#8][C@]%12([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]%12-[#8])-[#6@H]%11-[#8])-[#6](-[#8-])=O)-[#6@H]%10-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]%10([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]%10-[#8])-[#6@H]9-[#8])-[#6](-[#8-])=O)-[#6@H]8-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]8([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]8-[#8])-[#6@H]7-[#8])-[#6](-[#8-])=O)-[#6@H]6-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]6([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]6-[#8])-[#6@H]5-[#8])-[#6](-[#8-])=O)-[#6@H]4-[#7]-[#6](-[#6])=O)-[#6@H](-[#8][C@]4([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]4-[#8])-[#6@H]3-[#8])-[#6](-[#8-])=O)-[#6@H]2-[#7]-[#6](-[#6])=O)-[#6@H](-[#8])-[#6](-[#8-])=O)[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]1-[#8] |r,c:127|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 17n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human citrated plasma iXase (factor 8a-factor 9a complex) preincubated for 2 mins followed by factor 10 addition and measured after 1 m...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112796
BindingDB Entry DOI: 10.7270/Q28D0113
More data for this
Ligand-Target Pair
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50458155
PNG
(CHEMBL4210593)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]([#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]2([H])[#8]-[#6@H](-[#6](-[#8-])=O)[C@@]([H])([#8]-[#6@@H]-3-[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]4([H])[#8]-[#6](=[#6]-[#6@H](-[#8][C@]5([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]5-[#8]S([#8-])(=O)=O)-[#6@H]4-[#8])-[#6](-[#8-])=O)-[#6@H]-3-[#7]-[#6](-[#6])=O)[#6@H](-[#8][C@]3([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]3-[#8]S([#8-])(=O)=O)-[#6@H]2-[#8])-[#6@H]-1-[#7]-[#6](-[#6])=O)([#6@H](-[#8])-[#6](-[#8-])=O)[#6@H](-[#8][C@]1([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]1-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6]-[#8] |r,c:50|
Show InChI InChI=1S/C52H82N2O70S10.13Na/c1-10-28(117-127(77,78)79)23(60)38(122-132(92,93)94)50(103-10)106-16-6-17(43(65)66)107-48(22(16)59)111-34-21(54-14(5)57)47(109-19(9-102-126(74,75)76)32(34)120-130(86,87)88)115-41-37(114-52-40(124-134(98,99)100)25(62)30(12(3)105-52)119-129(83,84)85)27(64)49(116-42(41)45(69)70)112-35-20(53-13(4)56)46(108-18(8-101-125(71,72)73)33(35)121-131(89,90)91)113-36(26(63)44(67)68)31(15(58)7-55)110-51-39(123-133(95,96)97)24(61)29(11(2)104-51)118-128(80,81)82;;;;;;;;;;;;;/h6,10-12,15-16,18-42,46-52,55,58-64H,7-9H2,1-5H3,(H,53,56)(H,54,57)(H,65,66)(H,67,68)(H,69,70)(H,71,72,73)(H,74,75,76)(H,77,78,79)(H,80,81,82)(H,83,84,85)(H,86,87,88)(H,89,90,91)(H,92,93,94)(H,95,96,97)(H,98,99,100);;;;;;;;;;;;;/q;13*+1/p-13/t10-,11-,12-,15-,16-,18+,19+,20+,21+,22+,23+,24+,25+,26-,27+,28+,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42-,46-,47-,48-,49+,50-,51-,52-;;;;;;;;;;;;;/m0............./s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 98.7n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human intrinsic factor tenase using factor-10 as substrate preincubated for 2 mins followed by substrate addition for 1 min measured ev...


Eur J Med Chem 148: 423-435 (2018)


Article DOI: 10.1016/j.ejmech.2018.02.047
BindingDB Entry DOI: 10.7270/Q2M0483C
More data for this
Ligand-Target Pair
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50458157
PNG
(CHEMBL4216002)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]([#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]2([H])[#8]-[#6](=[#6]-[#6@H](-[#8][C@]3([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]3-[#8]S([#8-])(=O)=O)-[#6@H]2-[#8])-[#6](-[#8-])=O)-[#6@H]-1-[#7]-[#6](-[#6])=O)([#6@H](-[#8])-[#6](-[#8-])=O)[#6@H](-[#8][C@]1([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]1-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6]-[#8] |r,c:23|
Show InChI InChI=1S/C32H51NO43S6.8Na/c1-7-19(72-78(48,49)50)16(38)25(75-81(57,58)59)31(64-7)66-11-4-12(27(41)42)67-30(15(11)37)70-23-14(33-9(3)35)29(68-13(6-63-77(45,46)47)22(23)74-80(54,55)56)71-24(18(40)28(43)44)21(10(36)5-34)69-32-26(76-82(60,61)62)17(39)20(8(2)65-32)73-79(51,52)53;;;;;;;;/h4,7-8,10-11,13-26,29-32,34,36-40H,5-6H2,1-3H3,(H,33,35)(H,41,42)(H,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;;;;;/q;8*+1/p-8/t7-,8-,10-,11-,13+,14+,15+,16+,17+,18-,19+,20+,21+,22-,23+,24+,25-,26-,29-,30-,31-,32-;;;;;;;;/m0......../s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.15E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human intrinsic factor tenase using factor-10 as substrate preincubated for 2 mins followed by substrate addition for 1 min measured ev...


Eur J Med Chem 148: 423-435 (2018)


Article DOI: 10.1016/j.ejmech.2018.02.047
BindingDB Entry DOI: 10.7270/Q2M0483C
More data for this
Ligand-Target Pair
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50458156
PNG
(CHEMBL4204328)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]1([#8]-[#6@H](-[#6@H](-[#6]-[#8])-[#7]-[#6](-[#6])=O)-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8])-[#6]-[#8]S([#8-])(=O)=O)[#8]-[#6](=[#6]-[#6@H](-[#8][C@]2([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@@H]2-[#8]S([#8-])(=O)=O)-[#6@H]1-[#8])-[#6](-[#8-])=O |r,c:26|
Show InChI InChI=1S/C20H33NO27S4.5Na/c1-6-14(46-50(32,33)34)13(26)17(48-52(38,39)40)20(42-6)43-10-3-11(18(27)28)44-19(12(10)25)45-15(8(4-22)21-7(2)23)16(47-51(35,36)37)9(24)5-41-49(29,30)31;;;;;/h3,6,8-10,12-17,19-20,22,24-26H,4-5H2,1-2H3,(H,21,23)(H,27,28)(H,29,30,31)(H,32,33,34)(H,35,36,37)(H,38,39,40);;;;;/q;5*+1/p-5/t6-,8-,9+,10-,12+,13+,14+,15+,16-,17-,19-,20-;;;;;/m0...../s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.32E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human intrinsic factor tenase using factor-10 as substrate preincubated for 2 mins followed by substrate addition for 1 min measured ev...


Eur J Med Chem 148: 423-435 (2018)


Article DOI: 10.1016/j.ejmech.2018.02.047
BindingDB Entry DOI: 10.7270/Q2M0483C
More data for this
Ligand-Target Pair
Coagulation factor IX/VIII


(Homo sapiens (Human))
BDBM50565730
PNG
(CHEMBL4792554)
Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[H][C@@]1([#8]-[#6@H](-[#6@@H](-[#8])-[#6]-[#8])-[#6@H](-[#8][C@]2([H])[#8]-[#6@H](-[#6]-[#8]S([#8-])(=O)=O)-[#6@H](-[#8]S([#8-])(=O)=O)-[#6@H](-[#8][C@]3([H])[#8]-[#6](=[#6]-[#6@H](-[#8][C@]4([H])[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]4-[#8])-[#6@H]3-[#8])-[#6](-[#8-])=O)-[#6@H]2-[#7]-[#6](-[#6])=O)-[#6@H](-[#8])-[#6](-[#8-])=O)[#8]-[#6@@H](-[#6])-[#6@@H](-[#8]S([#8-])(=O)=O)-[#6@@H](-[#8]S([#8])(=O)=O)-[#6@@H]1-[#8] |r,c:31|
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human citrated plasma iXase (factor 8a-factor 9a complex) preincubated for 2 mins followed by factor 10 addition and measured after 1 m...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112796
BindingDB Entry DOI: 10.7270/Q28D0113
More data for this
Ligand-Target Pair